Molecule Details

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

Molecular Properties
SMILES:
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)C1CCN(C(=O)CCl)CC1
MW: 449.08
Fraction sp3: 0.65
HBA: 6
HBD: 1
Rotatable Bonds: 6
TPSA: 96.02
cLogP: 0.86
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(NCc1ccccc1S(=O)(=O)N1CCOCC1)C1CCN(C(=O)CCl)CC1

MAK-UNK-69bf97dd-6
0.552

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C=CC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

SAD-SAT-2ceae68f-9
0.551

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

SAD-SAT-29425be4-14
0.544

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O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)c1cncnc1

MAR-TRE-a9136c7b-17
0.524

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O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)Nc1cccnc1

MAK-UNK-009ebe36-4
0.473

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

MAK-UNK-69bf97dd-5
0.467

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

MAK-UNK-69bf97dd-9
0.449

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

MAK-UNK-69bf97dd-8
0.444

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

MAK-UNK-69bf97dd-7
0.435

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

SAD-SAT-f2e2579e-3
0.432

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

MAK-UNK-69bf97dd-1
0.426

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

SAD-SAT-f2e2579e-9
0.411

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(Br)s2)CC1

NIM-UNI-05f93fcc-1
0.400

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

SAD-SAT-29425be4-6
0.400

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(OCC3CCOCC3)s2)CC1

NIM-UNI-310206f0-70
0.394

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(Cc3cccc4ccccc34)s2)CC1

MAK-UNK-e05327b2-8
0.392

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1

AAR-POS-0daf6b7e-15
0.388

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O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)s1)Nc1cccnc1

MAK-UNK-009ebe36-5
0.381

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O=C(CCl)N1CCC(C(=O)N2CCN(c3ccc(S(=O)(=O)N4CCOCC4)cc3[N+](=O)[O-])CC2)CC1

SAD-SAT-9a6c5cf3-1
0.379

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O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)Nc1cccnc1

MAR-TRE-2fd8122f-94
0.375

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

MAK-UNK-69bf97dd-10
0.370

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

SAD-SAT-29425be4-19
0.370

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

MAK-UNK-3d7e3904-3
0.367

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

MAK-UNK-750cfbcc-2
0.365

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

MAK-UNK-69bf97dd-2
0.363

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

LON-WEI-120e5cf5-15
0.361

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

MAR-TRE-6a44bbf2-86
0.361

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

SAD-SAT-29425be4-20
0.359

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

SAD-SAT-29425be4-15
0.359

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(C3=CCOCC3)s2)CC1

NIM-UNI-310206f0-68
0.358

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

SAD-SAT-29425be4-29
0.357

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

SAD-SAT-29425be4-9
0.357

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

LON-WEI-120e5cf5-20
0.357

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

YOI-UNK-a533afbc-1
0.353

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

YOI-UNK-12211982-1
0.353

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3ccc(O)cc3)s2)CC1

NIM-UNI-05f93fcc-14
0.352

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3ncco3)s2)CC1

NIM-UNI-05f93fcc-9
0.351

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

SAD-SAT-29425be4-3
0.351

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

LON-WEI-120e5cf5-10
0.349

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

MAR-TRE-6a44bbf2-15
0.349

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

AAR-POS-0daf6b7e-6
0.349

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3ccccc3Cl)s2)CC1

NIM-UNI-05f93fcc-3
0.348

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3nccs3)s2)CC1

NIM-UNI-05f93fcc-13
0.348

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Cc1ccc(-c2ccc(S(=O)(=O)N3CCN(C(=O)CCl)CC3)s2)cc1

NIM-UNI-05f93fcc-11
0.344

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Cc1cc(C)cc(-c2ccc(S(=O)(=O)N3CCN(C(=O)CCl)CC3)s2)c1

NIM-UNI-05f93fcc-7
0.344

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

SAD-SAT-f2e2579e-8
0.343

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O=C(CCl)N1CCC(C(=O)N2CNCO2)CC1

MAK-UNK-704ed37c-6
0.341

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

LON-WEI-120e5cf5-16
0.341

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

MAK-UNK-c97f7c8f-1
0.341

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3ccccc3)s2)CC1

NIM-UNI-05f93fcc-2
0.341

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

LON-WEI-120e5cf5-19
0.341

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

MAK-UNK-69bf97dd-4
0.340

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

LON-WEI-120e5cf5-11
0.337

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

AAR-POS-5507155c-2
0.337

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3ccncc3)s2)CC1

NIM-UNI-310206f0-69
0.337

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

AAR-POS-f650c5f2-4
0.337

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

LON-WEI-120e5cf5-1
0.337

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

LON-WEI-120e5cf5-17
0.337

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3cccnc3)s2)CC1

NIM-UNI-05f93fcc-6
0.337

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

MAK-UNK-c97f7c8f-2
0.333

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O=C(CCl)N1CCC(C(=O)N2CCOC2)CC1

MAK-UNK-704ed37c-3
0.333

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

LON-WEI-120e5cf5-14
0.333

View
O=C(Nc1ccccc1Oc1ccccn1)C1CCN(C(=O)CCl)CC1

MAK-UNK-a7992eb3-8
0.333

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

SAD-SAT-29425be4-4
0.330

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3cncnc3)s2)CC1

NIM-UNI-310206f0-67
0.330

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3ccc[nH]3)s2)CC1

NIM-UNI-05f93fcc-5
0.330

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

SAD-SAT-f2e2579e-5
0.330

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

LON-WEI-120e5cf5-13
0.330

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

SAD-SAT-9a6c5cf3-6
0.327

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

SAD-SAT-29425be4-13
0.326

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

LON-WEI-120e5cf5-12
0.326

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3c[nH]cn3)s2)CC1

NIM-UNI-05f93fcc-17
0.326

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3cn[nH]c3)s2)CC1

NIM-UNI-310206f0-71
0.326

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

LON-WEI-120e5cf5-21
0.326

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O=C(CCl)N1CCC(S(=O)(=O)c2cccs2)CC1

MAK-UNK-987948f6-15
0.326

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COc1ccc(-c2ccc(S(=O)(=O)N3CCN(C(=O)CCl)CC3)s2)cc1

NIM-UNI-05f93fcc-15
0.323

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3ccc(C(F)(F)F)cc3)s2)CC1

NIM-UNI-05f93fcc-10
0.323

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

SAD-SAT-9a6c5cf3-5
0.323

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

MAK-UNK-3d7e3904-2
0.323

View
O=C(CCl)N1CCN(S(=O)(=O)c2cccs2)CC1

MAR-TRE-6a44bbf2-52
0.321

View
O=C(CCl)N1CCN(S(=O)(=O)c2cccs2)CC1

LON-WEI-8f408cad-3
0.321

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

SAD-SAT-29425be4-10
0.321

View
O=C(CCl)N1CCN(S(=O)(=O)c2cccs2)CC1

AAR-POS-d2a4d1df-22
0.321

View
N#Cc1ccccc1S(=O)(=O)N1CCN(C(=O)C2CCN(C(=O)CCl)CC2)CC1

SAD-SAT-f2e2579e-4
0.320

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

SAD-SAT-9a6c5cf3-9
0.320

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

SAD-SAT-9a6c5cf3-7
0.320

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

SAD-SAT-9a6c5cf3-10
0.320

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

SAD-SAT-f2e2579e-10
0.320

View
O=C(CCl)NCc1ccccc1S(=O)(=O)N1CCOCC1

AHN-SAT-de2502ba-12
0.319

View
O=C(CCl)NCc1ccccc1S(=O)(=O)N1CCOCC1

MAR-TRE-6a44bbf2-20
0.319

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

LON-WEI-120e5cf5-3
0.319

View
O=C(CCl)NCc1ccccc1S(=O)(=O)N1CCOCC1

SAD-SAT-65574d3f-8
0.319

View
O=C(CCl)C1CCN(S(=O)(=O)c2cccs2)CC1

BEN-DND-76ad4ac9-1
0.318

View
CC(C)(C)c1cccc(C(NC(=O)C2CCN(C(=O)CCl)CC2)c2ccc(Cl)cc2)c1

SAD-SAT-29425be4-25
0.317

View
CC(C)N(Cc1ccc(-c2ccccc2)s1)C(=O)C1CCN(C(=O)CCl)CC1

SAD-SAT-29425be4-16
0.317

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

MAK-UNK-a7992eb3-7
0.316

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

LON-WEI-120e5cf5-4
0.316

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3cccc4ncoc34)s2)CC1

NIM-UNI-05f93fcc-12
0.314

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

SAD-SAT-f2e2579e-7
0.314

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3ccc4cc[nH]c4c3)s2)CC1

NIM-UNI-05f93fcc-4
0.314

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(F)CC1

0.593

View
CC(=O)NCc1ccc(S(=O)(=O)N2CCCOCC2)s1

0.567

View
O=C(NCCO)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.705

View
CCNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.700

View
C#CCNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.689

View
CCCNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.689

View
O=C(NC1CC1)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.683

View
O=C(NCCCO)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.683

View
CNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.667

View
O=C(NCC(F)(F)F)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.667

View
CC(C)CNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.667

View
O=C(NCc1cccnc1)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.657

View
CCCCNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.656

View
COCCNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.646

View
CCCCCNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.646

View
O=C(Nc1ccccc1)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.635

View
CONC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.635

View
O=C(NC1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1)C1CC1

0.629

View
O=C(NC1CCCCC1)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.625

View
NC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.617

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(C(=O)N2CCOCC2)CC1

0.617

View
CC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.617

View
O=C(Nc1ccc(F)cc1)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.615

View
COC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.613

View
CC(=O)NCc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCOCC3)CC2)s1

0.613

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(O)CC1

0.610

View
CC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.607

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NCCNC(=O)C1CC1

0.607

View
CC(=O)NCc1ccc(S(=O)(=O)N2CCC(C(=O)NCCCN3CCOCC3)CC2)s1

0.597

View
CC(=O)NCc1ccc(S(=O)(=O)N2CCC(CC(=O)N3CCOCC3)CC2)s1

0.594

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(C2CC2)CC1

0.593

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(CO)CC1

0.590

View
O=C(Nc1nncs1)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.588

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(C(=O)C(F)(F)F)CC1

0.587

View
O=C(c1ccc(Cl)cc1)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.585

View
CC1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.583

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)C1CC1

0.583

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(N2CCOCC2)CC1

0.583

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NCCCNC(=O)C1CCC1

0.578

View
C#CCNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCCC3)s2)CC1

0.578

View
O=C(c1ccccc1)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.578

View
CC(=O)NCC1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.578

View
CC1CCN(C(=O)C2CCN(C(=O)Cc3ccc(S(=O)(=O)N4CCOCC4)s3)CC2)CC1

0.578

View
O=C(NCCO)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCCC3)s2)CC1

0.578

View
O=C(NC1CN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)C1)C1CC1

0.578

View
O=C(NCc1ccc(F)cc1)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCCC3)s2)CC1

0.576

View
CON(C)C(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.576

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCN(C(=O)C2CC2)CC1

0.574

View
CCC1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.574

View
C#CC1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.574

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)C1CCOCC1

0.574

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(C2CCCC2)CC1

0.574

View
CCNC(=O)C1CCN(S(=O)(=O)c2ccc(CNC(C)=O)s2)CC1

0.574

View
O=C(NCc1ccc(Cl)s1)C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1

0.571

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCOCC1

0.571

View
O=C(Cc1ccc(S(=O)(=O)N2CCCC2)s1)N1CCC(C(=O)N2CCOCC2)CC1

0.571

View
CCNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCCC3)s2)CC1

0.571

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(OC2CCCC2)CC1

0.571

View
O=C(Nc1cccc(F)c1)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.571

View
NC(=O)NC1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.571

View
NC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)C1

0.571

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCCC(O)CC1

0.571

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(CCO)CC1

0.571

View
CC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)C1

0.571

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(OC2CCC2)CC1

0.571

View
CNS(=O)(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.571

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(NC2CCC2)CC1

0.571

View
CC(=O)NCc1ccc(S(=O)(=O)N2CCC(C(=O)NCCO)CC2)s1

0.571

View
C#CCNC(=O)C1CCN(S(=O)(=O)c2ccc(CNC(C)=O)s2)CC1

0.571

View
C#CCNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)s2)CC1

0.569

View
CCOC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.569

View
O=C(NCCC(=O)N1CCOCC1)C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1

0.569

View
CN1CCN(C(=O)C2CCN(C(=O)Cc3ccc(S(=O)(=O)N4CCOCC4)s3)CC2)CC1

0.569

View
COC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)C1

0.569

View
O=C(NCCO)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)s2)CC1

0.569

View
NS(=O)(=O)c1ccc(CNC(=O)C2CCOCC2)s1

0.569

View
CS(=O)(=O)c1ccc(CNC(=O)C2CCOCC2)s1

0.569

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(C2CCCCC2)CC1

0.565

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NCc1ccc(Cl)s1

0.565

View
C=CC1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.565

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(N2CCCC2)CC1

0.565

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)C1CCCC1

0.565

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CC[C@H](O)C1

0.565

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(CC(=O)N2CCOCC2)CC1

0.565

View
N#CC1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.565

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CC[C@@H](O)C1

0.565

View
NS(=O)(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.565

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)C1CCC1

0.565

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(O)C1

0.565

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCN(C2CCOCC2)CC1

0.565

View
CS(=O)(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.565

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(N2CCC2)CC1

0.565

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CC[C@@H](O)[C@@H](O)C1

0.565

View
CC(=O)NCc1ccc(S(=O)(=O)N2CCC(N3CCOCC3)CC2)s1

0.565

View
Cc1ccc(NC(=O)C2CCN(C(=O)Cc3ccc(S(=O)(=O)N4CCOCC4)s3)CC2)nc1

0.563

View
CC(=O)NC1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.562

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCC(OC2CCCCC2)CC1

0.562

View
CS(=O)(=O)NC1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1

0.562

View
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)s1)N1CCC(C(=O)N2CCOCC2)CC1

0.562

View
CCNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)s2)CC1

0.562

View
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)c1ccccc1

0.200

View
Cc1ccc(C(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)s2)cc1

0.200

View
COc1cccc(CC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)s2)c1

0.199

View
Cc1cc(C)cc(C(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)s2)c1

0.198

View
Cc1cccc(C(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)s2)c1

0.198

View
CC(NS(=O)(=O)c1ccc(F)cc1)C(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.197

View
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)C2CC(=O)N(C3CCCC3)C2)s1

0.197

View
O=C(Cc1ccccc1Br)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.194

View
Cc1ccc(C(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)s2)s1

0.194

View
O=C(Cc1ccc(Br)cc1)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.192

View
O=C(Cc1cccs1)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.186

View
O=C(Cc1ccc(F)cc1)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.186

View
CC(C)(C)c1ccc(OCCCC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)s2)cc1

0.184

View
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)c1cccs1

0.182

View
COC(=O)NCC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.181

View
O=C(CCCN1C(=O)c2ccccc2C1=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.181

View
COc1ccc(CC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)s2)cc1

0.179

View
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)C1CC(=O)N(c2ccccc2)C1

0.178

View
O=C(Cc1ccc(Cl)cc1)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.175

View
COc1ccnc(N2CCC(C(=O)NCc3ccc(S(=O)(=O)N4CCOCC4)s3)CC2)n1

0.175

View
CC(C)C(C(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1)c1ccc(Cl)cc1

0.167

View
Cc1ccccc1CC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.167

View
CCCC=CC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.166

View
O=S(=O)(c1ccc(CNC2CCCC2)s1)N1CCOCC1

0.163

View
CC(=O)NC(C)C(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.161

View
O=C(CC12CC3CC(CC(O)(C3)C1)C2)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.154

View
C=CC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.152

View
CC1(C)NC(=O)N(CCCC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)s2)C1=O

0.147

View
O=C(CC1C=CCC1)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.143

View
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)C1CCN(C(=O)c2ccco2)CC1

0.135

View
O=C(CCNC(=O)C12CC3CC(CC(C3)C1)C2)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.132

View
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)C1(c2ccccc2)CC1

0.131

View
COCCC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.130

View
O=C(CC1CCCCC1)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.120

View
CCC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.117

View
O=C(CC1CCCC1)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.116

View
CC(Cl)C(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.114

View
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)C1CC2CCC1C2

0.104

View
CCCC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.100

View
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)C1CC1C1CC1

0.096

View
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)C1CCCCC1

0.093

View
CCC(C)C(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.075

View
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)C1CCC1

0.074

View
CC1CC1C(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1

0.074

View
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)C1CC1

0.071

View
C(N(CCOC)CC1SC=CC=1)(=O)C1CCN(S(C2SC=CC=2)(=O)=O)CC1

0.769

View
C(N(CCC)CC1SC=CC=1)(=O)C1CCN(S(C2SC=CC=2)(=O)=O)CC1

0.754

View
C(N(CCCOC)CC1SC=CC=1)(=O)C1CCN(S(C2SC=CC=2)(=O)=O)CC1

0.754

View
C(N(CCOC)CC1SC=CC=1)(=O)C1CCN(S(C2SC(Cl)=CC=2)(=O)=O)CC1

0.749

View
C(NCC1CCN(CC2SC=CC=2)CC1)(=O)C1CCN(S(C2SC=CC=2)(=O)=O)CC1

0.742

View


Discussion: