Molecule Details

O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCN(C(=O)CCl)CC1

Molecular Properties
SMILES:
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCN(C(=O)CCl)CC1
MW: 441.15
Fraction sp3: 0.6
HBA: 4
HBD: 1
Rotatable Bonds: 6
TPSA: 86.79
cLogP: 1.95
Covalent Warhead: ✔️
Covalent Fragment: ✔️

Hetero_hetero

O=C(NC1CCN(C(=O)CCl)CC1)c1ccccc1

AAR-POS-0daf6b7e-5

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O=C(Nc1ccccc1O)C1CCN(C(=O)CCl)CC1

AAR-POS-0daf6b7e-6

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O=C(NCc1cccc(S(=O)(=O)N2CCCCC2)c1)C1CCN(C(=O)CCl)CC1

MAK-UNK-69bf97dd-1
0.675

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O=C(NCc1ccccc1S(=O)(=O)N1CCCCC1)C1CCN(C(=O)CCl)CC1

MAK-UNK-69bf97dd-7
0.568

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O=C(NCc1ccccc1S(=O)(=O)N1CCCC1)C1CCN(C(=O)CCl)CC1

MAK-UNK-69bf97dd-8
0.524

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O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCN(C(=O)CCl)CC2)cc1

SAD-SAT-29425be4-29
0.488

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CC(C)c1ccc(CCCNC(=O)C2CCN(C(=O)CCl)CC2)cc1

SAD-SAT-29425be4-15
0.463

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CC(C)(C)c1ccc(S(=O)(=O)CCNC(=O)C2CCN(C(=O)CCl)CC2)cc1

SAD-SAT-29425be4-6
0.458

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O=C(CCl)N1CCC(C(=O)N2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC1

SAD-SAT-9a6c5cf3-5
0.452

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O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)C1CCN(C(=O)CCl)CC1

MAK-UNK-69bf97dd-3
0.449

View
Cc1ccc(S(=O)(=O)N2CCCN(C(=O)C3CCN(C(=O)CCl)CC3)CC2)cc1

SAD-SAT-9a6c5cf3-2
0.448

View
NS(=O)(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)C3CCN(C(=O)CCl)CC3)CC2)cc1

SAD-SAT-f2e2579e-5
0.446

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O=C(NCc1ccccc1S(=O)(=O)N1CCOCC1)C1CCN(C(=O)CCl)CC1

MAK-UNK-69bf97dd-6
0.444

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O=C(CCl)N1CCC(C(=O)N2CCN(S(=O)(=O)c3ccc(C4CCCCC4)cc3)CC2)CC1

SAD-SAT-9a6c5cf3-9
0.443

View
N#Cc1ccc(S(=O)(=O)N2CCN(C(=O)C3CCN(C(=O)CCl)CC3)CC2)cc1

SAD-SAT-f2e2579e-10
0.430

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CC(C)(C)c1ccc(CNC(=O)C2CCN(C(=O)CCl)CC2)s1

SAD-SAT-29425be4-14
0.427

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CC(C)(C)OC(=O)Cc1cccc(CNC(=O)C2CCN(C(=O)CCl)CC2)c1

SAD-SAT-29425be4-9
0.422

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O=C(O)c1ccc(S(=O)(=O)N2CCCCC2)cc1

CLI-UNI-032f7715-4
0.420

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Cc1ccccc1OCCCC(=O)Nc1ccc(CNC(=O)C2CCN(C(=O)CCl)CC2)cc1

SAD-SAT-29425be4-10
0.416

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(C3CC3)cc2)CC1

MAK-UNK-c74072e5-8
0.416

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1

MAK-UNK-7c9d1431-6
0.416

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O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1cccnc1

SAD-SAT-135344c3-2
0.414

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O=C(Nc1cc(S(=O)(=O)N2CCOCC2)ccc1O)C1CCN(C(=O)CCl)CC1

MAK-UNK-69bf97dd-5
0.413

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O=C(Nc1ccccc1)C1CCN(C(=O)CCl)CC1

MAR-TRE-6a44bbf2-86
0.403

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O=C(Nc1ccccc1)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-15
0.403

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1

AAR-POS-d2a4d1df-44
0.400

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O=C(Nc1ccc(Cl)cc1)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-20
0.397

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(Cc3cccc4ccccc34)cc2)CC1

MED-COV-4280ac29-5
0.396

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Cc1cccc(C(C)(C)CNC(=O)C2CCN(C(=O)CCl)CC2)c1

SAD-SAT-29425be4-20
0.395

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1

MAR-TRE-6a44bbf2-58
0.395

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Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)cc1

MAR-LAB-efb042c5-5
0.395

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1

KAY-MCD-d0fe5261-1
0.395

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Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)cc1

MAR-TRE-6a44bbf2-68
0.395

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O=C(CCl)Nc1ccc(S(=O)(=O)N2CCCC2)cc1

MAR-TRE-6a44bbf2-89
0.395

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Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)cc1

AAR-POS-d2a4d1df-27
0.395

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CNC(=O)C1CCN(C(=O)CCl)CC1

MAK-UNK-750cfbcc-2
0.391

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CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)cc1

MAK-UNK-7c9d1431-13
0.390

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CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)cc1

MAR-TRE-6a44bbf2-78
0.390

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CC(=O)c1ccc(NC(=O)C2CCN(C(=O)CCl)CC2)cc1

LON-WEI-120e5cf5-10
0.388

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Cc1ccc(SCCNC(=O)C2CCN(C(=O)CCl)CC2)cc1C

SAD-SAT-29425be4-3
0.386

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CCc1ccc(NC(=O)C2CCN(C(=O)CCl)CC2)nc1

MAK-UNK-c97f7c8f-2
0.386

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O=C(NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1)C1CCN(C(=O)CCl)CC1

MAK-UNK-69bf97dd-2
0.381

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COc1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)cc1

MAK-UNK-7c9d1431-17
0.380

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O=C(CCl)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1Cl

AHN-SAT-de2502ba-18
0.378

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COc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3cccnc3)CC2)cc1Cl

MAR-TRE-fd17a9b8-92
0.378

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O=C(N[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1)C1CCN(C(=O)CCl)CC1

MAK-UNK-69bf97dd-10
0.375

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CC(C)(CNC(=O)C1CCN(C(=O)CCl)CC1)c1coc(-c2ccccc2)n1

SAD-SAT-29425be4-4
0.375

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CC(C)Cc1ccc(C(NC(=O)C2CCN(C(=O)CCl)CC2)C(C)C)cc1

SAD-SAT-29425be4-13
0.375

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CN(C)c1ccc(C(CNC(=O)C2CCN(C(=O)CCl)CC2)N(C)C)cc1

SAD-SAT-29425be4-19
0.375

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CCCCc1ccc(C(NC(=O)C2CCN(C(=O)CCl)CC2)C(C)C)cc1

SAD-SAT-29425be4-12
0.374

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O=C(Nc1cccnc1)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-11
0.373

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O=C(CCl)N1CCC(C(=O)N2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)CC1

SAD-SAT-9a6c5cf3-6
0.372

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O=C(CCl)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21

AHN-SAT-de2502ba-11
0.372

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O=S(=O)(F)c1ccc(S(=O)(=O)N2CCCCC2)cc1

SAD-SAT-2fd372d1-6
0.371

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O=C(Nc1ccccc1O)C1CCN(C(=O)CCl)CC1

MAR-TRE-6a44bbf2-15
0.370

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O=C(Nc1ccccc1O)C1CCN(C(=O)CCl)CC1

AAR-POS-0daf6b7e-6
0.370

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O=C(CCl)N1CCN(S(=O)(=O)c2ccccc2)CC1

MAR-TRE-6a44bbf2-21
0.368

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O=C(CCl)N1CCN(S(=O)(=O)c2ccccc2)CC1

MAK-UNK-7c9d1431-9
0.368

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CCOc1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)cc1

MAK-UNK-7c9d1431-22
0.366

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1

MAK-UNK-7c9d1431-5
0.365

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1

MAR-TRE-6a44bbf2-31
0.365

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O=C(Nc1ccccc1Br)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-16
0.361

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O=C(CCl)Nc1cc(S(=O)(=O)N2CCCCCC2)ccc1Cl

AHN-SAT-de2502ba-17
0.361

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Cc1ccc(NC(=O)C2CCN(C(=O)CCl)CC2)nc1

MAK-UNK-c97f7c8f-1
0.361

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CC(=O)c1cccc(NC(=O)C2CCN(C(=O)CCl)CC2)c1

LON-WEI-120e5cf5-19
0.360

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Cc1cccnc1NC(=O)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-21
0.360

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O=C(NC1CCCC(C2CCCCC2)C1)C1CCN(C(=O)CCl)CC1

MAK-UNK-3d7e3904-1
0.360

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O=C(CCl)N1CCC(C(=O)N2CCCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1

SAD-SAT-f2e2579e-2
0.360

View
O=C(CCl)N1CCC(C(=O)N2CCCN(S(=O)(=O)c3ccc(Br)s3)CC2)CC1

SAD-SAT-f2e2579e-9
0.358

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NS(=O)(=O)c1ccc2cccc(NC(=O)C3CCN(C(=O)CCl)CC3)c2c1

MAK-UNK-69bf97dd-4
0.358

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O=C(CCl)N1CCC(C(=O)N2CCN(S(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)CC1

SAD-SAT-f2e2579e-7
0.357

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Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)CCl

AHN-SAT-de2502ba-10
0.357

View
O=C(Nc1ccccc1N1CCC1)C1CCN(C(=O)CCl)CC1

MAK-UNK-3d7e3904-2
0.356

View
COc1ccc(NC(=O)C2CCN(C(=O)CCl)CC2)cn1

LON-WEI-120e5cf5-1
0.356

View
COc1ccc(NC(=O)C2CCN(C(=O)CCl)CC2)cn1

AAR-POS-f650c5f2-4
0.356

View
COc1ccc(NC(=O)C2CCN(C(=O)CCl)CC2)cn1

LON-WEI-120e5cf5-17
0.356

View
COc1ccc(NC(=O)C2CCN(C(=O)CCl)CC2)cn1

AAR-POS-5507155c-2
0.356

View
O=C(CCl)N1CCC(C(=O)N2CCCCC2)CC1

VIR-GIT-7b3d3065-2
0.356

View
O=C(CCl)N1CCC(C(=O)N2CCCCC2)CC1

AAR-POS-0daf6b7e-9
0.356

View
COc1cc(NC(=O)C2CCN(C(=O)CCl)CC2)cc(OC)c1OC

LON-WEI-120e5cf5-3
0.353

View
O=C(COc1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)cc1)NCc1ccc2c(c1)OCO2

DAV-UNK-07f953a2-3
0.352

View
O=C(CCl)N1CCC(C(=O)N2CCN(S(=O)(=O)c3ccccc3F)CC2)CC1

SAD-SAT-9a6c5cf3-10
0.352

View
O=C(Nc1cc(Cl)nc2ccccc12)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-14
0.352

View
Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)N1CCN(C(=O)C2CCN(C(=O)CCl)CC2)CC1

SAD-SAT-9a6c5cf3-7
0.351

View
Cc1ccnc(NC(=O)C2CCN(C(=O)CCl)CC2)c1

LON-WEI-120e5cf5-13
0.349

View
O=C(Nc1ccc(N2CCNC2=O)cc1)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-4
0.348

View
O=C(Nc1ccccc1OC1CS(=O)(=O)C1)C1CCN(C(=O)CCl)CC1

MAK-UNK-a7992eb3-7
0.348

View
O=C(CCl)N1CCC(C(=O)N2CCCN(S(=O)(=O)c3cccs3)CC2)CC1

SAD-SAT-f2e2579e-8
0.347

View
C=CC(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1

SAD-SAT-1f400d17-2
0.346

View
O=C(CCl)N1CCC(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)s3)CC2)CC1

SAD-SAT-f2e2579e-3
0.344

View
O=C(Nc1ccn(-c2ccccc2)n1)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-12
0.344

View
O=C(Nc1ccc2c(c1)[nH]c1ccccc12)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-9
0.344

View
Cn1c(CNC(=O)C2CCN(C(=O)CCl)CC2)nc2c1C(n1os1)CCC2

YOI-UNK-12211982-1
0.343

View
Cn1c(CNC(=O)C2CCN(C(=O)CCl)CC2)nc2c1C(n1os1)CCC2

YOI-UNK-a533afbc-1
0.343

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccoc2)CC1

SAD-SAT-3a925b8b-2
0.342

View
O=C(CCl)Nc1cccc(S(=O)(=O)N2CCCCC2)c1

AHN-SAT-de2502ba-5
0.341

View
CC(=O)NCc1ccc(C2CCN(C(=O)CCl)CO2)cc1

NIM-UNI-43fe0159-8
0.341

View
O=C(Nc1ccccc1C1COC1)C1CCN(C(=O)CCl)CC1

MAK-UNK-3d7e3904-3
0.341

View
O=C(CCl)N1CCC(C(=O)N2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)CC1

SAD-SAT-f2e2579e-6
0.340

View
O=C(CCl)N1CCC(C(=O)N2CCCCCC2)CC1

MAK-UNK-750cfbcc-5
0.338

View
O=C(CCl)Nc1cc(S(=O)(=O)N2CCCC2)ccc1Cl

AHN-SAT-de2502ba-19
0.337

View
Cc1ccc(S(=O)(=O)NC2CCN(C(=O)CCl)CC2)cc1

WAR-XCH-79d12f6e-4
0.337

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CC=CCC1

0.667

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCN(C(=O)N2CCCC2)CC1

0.771

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CC1

0.756

View
NC(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.755

View
CC(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.755

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCN(C(=O)N2CCCC2)CC1

0.750

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCCCCCC1

0.739

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCCCCC1

0.739

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCCCCCC1

0.739

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCCCC1

0.739

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCCCCC1

0.739

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCCCC1

0.739

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCC1

0.739

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCCC1

0.739

View
NC(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.735

View
CC(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.735

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CC1

0.733

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCN(C(=O)COc2ccccc2)CC1

0.727

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCN(C(=O)NC2CC2)CC1

0.725

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCN(C(=O)CCc2ccccc2)CC1

0.722

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCCC1

0.717

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCC1

0.717

View
CN1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.714

View
CN(C)C(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.712

View
CC(C)C(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.712

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCN(C(=O)COc2ccccc2)CC1

0.709

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCC(F)CC1

0.708

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCN(C(=O)NC2CC2)CC1

0.706

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCN(C(=O)CCc2ccccc2)CC1

0.704

View
NS(=O)(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.700

View
CS(=O)(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.700

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCN(C2CC2)CC1

0.700

View
CCC(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)C1

0.698

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCC(O)CC1

0.694

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1C2CCCC21

0.694

View
CN1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.694

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1C2CCCCCCC21

0.694

View
O=C(O)[C@H]1CC[C@H](C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.694

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCNCC1

0.694

View
O=C(O)C1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.694

View
CC(C)C(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.692

View
CN(C)C(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.692

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCC(C2CC2)CC1

0.688

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCC(F)CC1

0.688

View
CCS(=O)(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.686

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCN(C(=O)Nc2ccccc2)CC1

0.685

View
CCOC(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.685

View
CCN(CC)C(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.685

View
O=C(NCCO)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.685

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCN(C(=O)c2ccc(Cl)cc2)CC1

0.685

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCN(C(=O)CCOc2ccccc2)CC1

0.684

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCN(C2CC2)CC1

0.680

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCOCC1

0.680

View
CC1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.680

View
C[C@H]1CC[C@H](C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.680

View
NS(=O)(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.680

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCSCC1

0.680

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCC(NC(=O)C2CC2)CC1

0.680

View
CS(=O)(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.680

View
NC1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.680

View
N[C@H]1CC[C@H](C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.680

View
N[C@H]1CC[C@@H](C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.680

View
CCC(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)C1

0.679

View
CCNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.679

View
CCNC(=O)C1CCN(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.679

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCC(O)CC1

0.673

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1C2CCCC21

0.673

View
O=C(O)C1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.673

View
O=C(O)[C@H]1CC[C@H](C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.673

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCNCC1

0.673

View
CC(C)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.673

View
O=C(NCc1ccc(F)cc1)C1CCN(C(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.673

View
CC(C)(C)OC(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.673

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)[C@@H]1CC=CCC1

0.667

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCN(C(=O)Nc2ccccc2)CC1

0.667

View
CCS(=O)(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.667

View
CCCNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.667

View
CC[C@H]1CC[C@H](C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.667

View
CC(=O)N1CC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)C1

0.667

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCS(=O)(=O)CC1

0.667

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCC2(CC1)CC2

0.667

View
CCOC(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.667

View
CCN(CC)C(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.667

View
O=C(NCCCO)C1CCN(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.661

View
C#CCN1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.660

View
O=C(NC1CC1)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.660

View
O=C(NC1CC1)C1CCN(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.660

View
CCNC(=O)C1CCN(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.660

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCOCC1

0.660

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCC(F)C1

0.660

View
CC1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.660

View
C[C@H]1CC[C@H](C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.660

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCSCC1

0.660

View
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCC(NC(=O)C2CC2)CC1

0.660

View
NC1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.660

View
N[C@H]1CC[C@H](C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.660

View
N[C@H]1CC[C@@H](C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.660

View
O=C(NCc1ccc(F)cc1)C1CCN(C(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1

0.655

View
CCNC(=O)C1CCN(C(=O)CCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.655

View
C#CCNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.655

View
O=C(NCc1ccccc1Cl)C1CCN(S(=O)(=O)c2ccccc2)CC1

0.189

View
O=C(NCc1ccccc1)C1CCN(S(=O)(=O)c2ccccc2Cl)CC1

0.189

View
CC1(C(=O)NCc2ccccc2)CCN(S(=O)(=O)c2ccc(Br)cc2)CC1

0.189

View
Cc1ccc(S(=O)(=O)N2CCC(CCC(=O)NCc3ccccc3)CC2)cc1

0.188

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3CN3CCCC3)CC2)cc1

0.188

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCC(C(=O)NCc4cccnc4)CC3)CC2)cc1

0.188

View
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)N(C)Cc3ccc4ccccc4c3)CC2)c(C)c1

0.188

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)Cc3ccc4ccccc4c3)CC2)c(C)c1

0.188

View
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NC(c3ccccc3)C3CC3)CC2)cc1

0.187

View
O=C(NCc1ccccc1)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1

0.187

View
CC(=O)NC(C(=O)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C(C)C

0.187

View
COc1ccc(CNC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1

0.185

View
Cc1cc(C)c(S(=O)(=O)N2CCC(C)(C(=O)NCc3ccc(F)cc3)CC2)c(C)c1

0.185

View
Cc1ccc(S(=O)(=O)N2CCC(C)(C(=O)NCc3ccc(F)cc3)CC2)c(C)c1

0.185

View
CCc1ccc(S(=O)(=O)N2CCC(C)(C(=O)NCc3ccc(F)cc3)CC2)cc1

0.185

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCC(C(N)=O)CC3)CC2)cc1

0.185

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCC(C(=O)N4CCCCC4)CC3)CC2)cc1

0.185

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCN(C(=O)OCC(F)(F)F)CC1

0.185

View
CCCCNC(=O)C1CCN(C(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1

0.185

View
CN(Cc1ccc2ccccc2c1)C(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1

0.185

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NC(CC(C)C)c3ccccc3)CC2)cc1

0.185

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccc(Cl)cc3Cl)CC2)cc1

0.184

View
Cc1ccc(S(=O)(=O)N2CCC(CC(=O)NCc3ccccc3)CC2)cc1

0.184

View
CCC(C)N(Cc1ccccc1)C(=O)C1CCN(S(=O)(=O)c2ccc(C(C)C)cc2)CC1

0.183

View
Cc1ccc(S(=O)(=O)N2CCC(C)(C(=O)NCc3ccccc3)CC2)cc1C

0.182

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NC(c3ccccc3)C3CC3)CC2)cc1

0.181

View
CC(NC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1)c1ccccc1

0.181

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)Cc3ccc(C)cc3C)CC2)cc1

0.180

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)c(Cl)c1

0.180

View
CC(C)c1ccc(CN(C(=O)C2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)C2CC2)cc1

0.180

View
CSc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)Cc3ccccc3)CC2)cc1

0.180

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)C(C)c3ccc(S(N)(=O)=O)cc3)CC2)cc1

0.180

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)Cc3cccc(Cl)c3)CC2)cc1

0.179

View
O=C(NCc1ccc(F)cc1)C1CCN(S(=O)(=O)c2ccccc2)CC1

0.178

View
CSc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1

0.178

View
Cc1ccc(CNC(=O)C2(C)CCN(S(=O)(=O)c3ccccc3C)CC2)cc1

0.178

View
Cc1ccc(CN2CCC(CNC(=O)CC3CCN(S(=O)(=O)c4ccc(C)cc4)CC3)CC2)cc1

0.178

View
Cc1ccc(CNC(=O)C2(C)CCN(S(=O)(=O)c3ccc(CC(C)C)cc3)CC2)cc1

0.177

View
CCN(Cc1ccccc1)C(=O)CCC1CCN(S(=O)(=O)c2ccc(C)cc2)CC1

0.177

View
O=C(NCc1ccc(Cl)cc1)C1CCN(S(=O)(=O)c2ccccc2)CC1

0.177

View
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)N(Cc3ccc(F)cc3)C3CC3)CC2)cc1

0.175

View
CC1CCCN(C(=O)C2CCN(C(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)CC2)C1

0.174

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N(Cc3ccc(C(C)C)cc3)C3CC3)CC2)cc1

0.174

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N(Cc3ccc(F)cc3)C3CC3)CC2)cc1

0.173

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N(Cc3ccc(F)cc3)C3CCCCC3)CC2)cc1

0.171

View
O=C(NC1CC1)C1CCN(C(=O)c2ccc(S(=O)(=O)N3CCCCCC3)cc2)CC1

0.171

View
Cc1ccc(CNC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)C)cc3)CC2)cc1

0.170

View
Cc1ccc(CNC(=O)C2(C)CCN(S(=O)(=O)c3ccc(C(C)(C)C)cc3)CC2)cc1

0.170

View
Cc1ccccc1S(=O)(=O)N1CCC(C)(C(=O)NCc2ccccc2)CC1

0.169

View
CC(C)Cc1ccc(S(=O)(=O)N2CCC(C)(C(=O)NCc3ccccc3)CC2)cc1

0.169

View
CCCc1ccc(S(=O)(=O)N2CCC(C)(C(=O)NCc3ccc(C)cc3)CC2)cc1

0.169

View
CN(Cc1ccc2ccccc2c1)C(=O)C1CCN(S(=O)(=O)c2ccc(C#N)cc2)CC1

0.167

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3Cl)CC2)cc1

0.164

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CC(=O)N(CC(F)(F)F)C1

0.163

View
CCCCCN(Cc1ccc(F)cc1)C(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1

0.163

View
CC1(C(=O)NCc2ccccc2)CCN(S(=O)(=O)c2ccc(C(C)(C)C)cc2)CC1

0.162

View
Cc1ccc(S(=O)(=O)N2CCC(C)(C(=O)NCc3ccccc3C)CC2)cc1

0.162

View
CC(C)c1ccc(S(=O)(=O)N2CCC(C)(C(=O)NCc3ccccc3)CC2)cc1

0.162

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NC(C)c3ccccc3)CC2)cc1

0.161

View
CCCc1ccc(S(=O)(=O)N2CCC(C)(C(=O)NCc3ccccc3)CC2)cc1

0.161

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)Cc3ccc4ccccc4c3)CC2)cc1

0.160

View
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccc(F)cc3)CC2)cc1

0.159

View
CC(C)(C)OC(=O)N1CCC(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1

0.159

View
CC1CCN(S(=O)(=O)c2ccc(C(=O)N3CCC(C(N)=O)CC3)cc2)CC1

0.157

View
CCc1ccc(S(=O)(=O)N2CCC(C)(C(=O)NCc3ccc(C)cc3)CC2)cc1

0.157

View
Cc1ccc(CNC(=O)C2(C)CCN(S(=O)(=O)c3c(C)cc(C)cc3C)CC2)cc1

0.157

View
Cc1ccc(CNC(=O)C2(C)CCN(S(=O)(=O)c3ccc(C)cc3C)CC2)cc1

0.157

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)Cc3ccc(F)cc3)CC2)cc1

0.155

View
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CCCCC1

0.154

View
CC1(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)CCCCC1

0.154

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)Cc3ccc(Cl)cc3)CC2)cc1

0.154

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccc(C(C)C)cc3)CC2)cc1

0.153

View
Cc1ccc(S(=O)(=O)N2CCC(C)(C(=O)NCc3ccc(F)cc3)CC2)cc1

0.152

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccc(Cl)cc3)CC2)cc1

0.152

View
Cc1ccc(CN(C)C(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)cc1

0.151

View
CC1CCN(S(=O)(=O)c2ccc(C(=O)N3CCC(C(=O)N4CCCCC4)CC3)cc2)CC1

0.151

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)Cc3ccccc3)CC2)c(C)c1

0.151

View
CCCN(Cc1ccc(C)cc1)C(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1

0.149

View
CCc1ccc(S(=O)(=O)N2CCC(C)(C(=O)NCc3ccccc3)CC2)cc1

0.149

View
Cc1ccc(CNC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)cc1

0.148

View
Cc1ccc(CNC(=O)C2(C)CCN(S(=O)(=O)c3ccccc3)CC2)cc1

0.148

View
Cc1cc(C)c(S(=O)(=O)N2CCC(C)(C(=O)NCc3ccccc3)CC2)c(C)c1

0.148

View
Cc1ccc(S(=O)(=O)N2CCC(C)(C(=O)NCc3ccccc3)CC2)c(C)c1

0.148

View
CCc1ccc(CN(C)C(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1

0.147

View
O=C(c1ccc(S(=O)(=O)N2CCCCC2)cc1)N1CCC(C(=O)N2CCCCC2)CC1

0.146

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccc(S(N)(=O)=O)cc3)CC2)c(C)c1

0.143

View
CCN(CC)Cc1ccc(CNC(=O)C2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)cc1

0.142

View
O=C1CC2(CCN(S(=O)(=O)c3ccccc3)CC2)CN1Cc1ccccc1

0.142

View
CCC(C)N(Cc1ccccc1)C(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1

0.141

View
O=C(NCc1ccccc1)C1CCN(S(=O)(=O)c2ccccc2)CC1

0.139

View
CC1(C(=O)NCc2ccccc2)CCN(S(=O)(=O)c2ccccc2)CC1

0.139

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N(Cc3ccccc3)C(C)C3CC3)CC2)cc1

0.131

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCC(C(=O)NC(C)c4ccccc4)CC3)CC2)cc1

0.129

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N(Cc3ccccc3)Cc3ccccc3)CC2)cc1

0.125

View
CCCN(Cc1ccc(C)cc1)C(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1

0.124

View
Cc1ccc(CNC(=O)C2(C)CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1

0.122

View
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)C2CCN(C(=O)C3CC3)CC2)cc1

0.120

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1

0.112

View
Cc1ccc(S(=O)(=O)N2CCC(C)(C(=O)NCc3ccccc3)CC2)cc1

0.112

View
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCC(C(=O)NCc4ccccc4)CC3)CC2)cc1

0.074

View
C(N1CCC(C(N(C)C)=O)CC1)(=O)C1=CC=C(S(N2CCCCC2)(=O)=O)C=C1

0.883

View
C(N(CC)CC1=CC=CC=C1)(=O)C1CCN(S(C2=CC=C(C)C=C2)(=O)=O)CC1

0.878

View
C(N1CCC(C(N(C)C)=O)CC1)(=O)C1=CC=C(S(N(CCCC)CCCC)(=O)=O)C=C1

0.877

View
C(NCC1CCN(CC2=CC=CC=C2)CC1)(=O)C1CCN(S(C2=CC=C(C)C=C2)(=O)=O)CC1

0.874

View
C(N(CCCC)CC1=CC=CC=C1)(=O)C1CCN(S(C2=CC=CC=C2)(=O)=O)CC1

0.874

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Discussion: