Molecule Details

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

Molecular Properties
SMILES:
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCN(C(=O)CCl)CC2)cc1
MW: 428.15
Fraction sp3: 0.35
HBA: 4
HBD: 1
Rotatable Bonds: 7
TPSA: 75.71
cLogP: 3.14
Covalent Warhead: ✔️
Covalent Fragment: ✔️

Ester

O=C(CCl)N1CCN(Cc2cccc(Cl)c2)CC1

MED-COV-4280ac29-15

View

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

MAK-UNK-69bf97dd-9
0.488

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

LON-WEI-120e5cf5-15
0.455

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

MAR-TRE-6a44bbf2-86
0.455

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

SAD-SAT-29425be4-9
0.451

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

SAD-SAT-29425be4-10
0.441

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

MAK-UNK-69bf97dd-1
0.430

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

LON-WEI-120e5cf5-14
0.411

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

SAD-SAT-29425be4-15
0.409

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

SAD-SAT-29425be4-14
0.407

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

LON-WEI-120e5cf5-10
0.402

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

MAK-UNK-69bf97dd-8
0.402

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O=C(Nc1ccccc1OC1CCN(Cc2ccccc2)CC1)C1CCN(C(=O)CCl)CC1

MED-COV-4280ac29-17
0.394

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

MAK-UNK-69bf97dd-7
0.394

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

LON-WEI-120e5cf5-16
0.393

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O=C(CCc1ccccc1)NC1CCN(C(=O)CCl)CC1

MAR-TRE-6a44bbf2-9
0.393

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

SAD-SAT-29425be4-4
0.388

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

AAR-POS-0daf6b7e-5
0.388

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

AAR-POS-0daf6b7e-6
0.386

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

MAR-TRE-6a44bbf2-15
0.386

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

MAK-UNK-c97f7c8f-2
0.384

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

MAK-UNK-69bf97dd-6
0.381

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CC(C)(C)OC(=O)C(C)(NC(=O)C1CCN(C(=O)CCl)CC1)c1ccccc1

SAD-SAT-29425be4-23
0.380

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

LON-WEI-120e5cf5-20
0.378

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

SAD-SAT-29425be4-20
0.378

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

LON-WEI-120e5cf5-19
0.375

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

LON-WEI-120e5cf5-12
0.374

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

SAD-SAT-29425be4-19
0.374

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

LON-WEI-120e5cf5-11
0.372

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

LON-WEI-120e5cf5-9
0.371

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O=C(NC(Cc1cccc(Oc2ccccc2)c1)C(=O)O)C1CCN(C(=O)CCl)CC1

YOI-UNK-15f562e8-1
0.370

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

MAK-UNK-750cfbcc-2
0.370

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

SAD-SAT-29425be4-3
0.370

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O=C(Nc1cccc(-c2cc[nH]n2)c1)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-2
0.365

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CC1C(Oc2ccccc2NC(=O)C2CCN(C(=O)CCl)CC2)CCCN1Cc1ccccc1

MAK-UNK-a7992eb3-5
0.364

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

MAK-UNK-a7992eb3-7
0.362

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CN(C(=O)C1CCN(C(=O)CCl)CC1)c1ccccc1

LON-WEI-120e5cf5-5
0.361

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O=C(Nc1ccccc1OCC1CN(Cc2ccccc2)CCO1)C1CCN(C(=O)CCl)CC1

MAK-UNK-a7992eb3-2
0.361

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O=C(Nc1cccc(C2=NN=C3CCCCC32)c1)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-6
0.359

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

SAD-SAT-29425be4-13
0.359

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

SAD-SAT-29425be4-6
0.359

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O=C(OCc1ccccc1)N1CCC(Cc2ccccc2)CC1

DRA-CSI-47e38074-4
0.357

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

MAK-UNK-69bf97dd-3
0.357

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

MAK-UNK-3d7e3904-3
0.356

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

MAK-UNK-3d7e3904-2
0.356

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

LON-WEI-120e5cf5-1
0.356

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

LON-WEI-120e5cf5-17
0.356

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

AAR-POS-f650c5f2-4
0.356

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

AAR-POS-5507155c-2
0.356

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

LON-WEI-120e5cf5-3
0.352

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O=C(CCl)N1CCC(C(c2ccccc2)c2ccccc2)CC1

MAK-UNK-6ca90168-11
0.346

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

MAK-UNK-c97f7c8f-1
0.345

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

LON-WEI-120e5cf5-21
0.344

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CC(C)COc1ccc(C(C)NC(=O)C2CCN(C(=O)CCl)CC2)cc1

SAD-SAT-29425be4-28
0.344

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

JAG-SYN-9c2cd0bd-8
0.341

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CCN(C(=O)C1CCN(C(=O)CCl)CC1)C(CF)c1ccccc1

YOI-UNK-a533afbc-6
0.337

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CCN(C(=O)C1CCN(C(=O)CCl)CC1)C(CF)c1ccccc1

YOI-UNK-12211982-6
0.337

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

MAK-UNK-a7992eb3-8
0.337

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NCCC(CCl)C(=O)c1ccc2c(c1)[nH]c1cc(NC(=O)C3CCN(C(=O)CCl)CC3)ccc12

ASH-SAT-43770c7d-7
0.336

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O=C(S)C1CCN(C(=O)Cc2ccccc2)CC1

GIA-UNK-5ec6c2b8-5
0.333

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

LON-WEI-120e5cf5-13
0.333

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

MAK-UNK-750cfbcc-1
0.333

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O=C(Nc1ccccc1OC1CCN(Cc2ccsc2)CC1)C1CCN(C(=O)CCl)CC1

MAK-UNK-a7992eb3-1
0.333

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

LON-WEI-120e5cf5-4
0.333

View
O=C(CCl)N1CCN(Cc2ccccc2)CC1

MAK-UNK-7c9d1431-24
0.333

View
CC(=O)N[C@H](C(=O)NCC#CBr)[C@H](C)Oc1ccccc1NC(=O)C1CCN(C(=O)CCl)CC1

MAK-UNK-a7992eb3-6
0.330

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

SAD-SAT-29425be4-12
0.330

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

MAK-UNK-3d7e3904-1
0.330

View
O=C(OCc1ccccc1)C1CCCN1c1cnc(CCl)[nH]1

MAR-TRE-87acfbcc-18
0.327

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O=C(c1cccc(F)c1)C1CCN(C(=O)CCl)CC1

BEN-DND-76ad4ac9-4
0.326

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Nc1ccc(NC(=O)c2ccc(CNC(=O)C3CCCC3)cc2)cn1

MAR-TRE-f6f5f473-77
0.323

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O=C(Nc1ccccc1OCC1(c2ccccn2)CCCC1)C1CCN(C(=O)CCl)CC1

MAK-UNK-a7992eb3-9
0.321

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

MAK-UNK-750cfbcc-5
0.321

View
O=C(NC1CCN(C(=O)CCl)CC1NCc1ccccc1)c1ccccc1

SIM-SYN-7db9eb24-1
0.320

View
CS(=O)(=O)N(CCc1ccccc1)CC1CCN(C(=O)CCl)CC1

DUN-NEW-f8ce3686-25
0.319

View
O=C(CCl)N1CCC(Oc2ccsc2)CC1

MAK-UNK-212f693e-10
0.318

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

YOI-UNK-a533afbc-1
0.317

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

YOI-UNK-12211982-1
0.317

View
CC(C)(C)C1CN(C(=O)C2CCN(C(=O)CCl)CC2)CCN1CCOc1ccccc1

SAD-SAT-29425be4-26
0.317

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

MAK-UNK-69bf97dd-4
0.317

View
CC(=O)NC(Cc1ccc(Oc2ccccc2NC(=O)C2CCN(C(=O)CCl)CC2)cc1)C(=O)NCC#CBr

MAK-UNK-a7992eb3-3
0.317

View
O=C(CCl)NC(=O)OCc1ccccc1

MAK-UNK-f983951f-5
0.316

View
C=CCOc1ccc(CN(C(=O)C2CCN(C(=O)CCl)CC2)C(C)(C)C)cc1

SAD-SAT-29425be4-11
0.316

View
O=C(CCl)N1CCC(C(=O)N2CCCC2)CC1

MAR-TRE-6a44bbf2-79
0.312

View
O=C(CCl)N1CCC(C(=O)N2CCCC2)CC1

MAK-UNK-750cfbcc-3
0.312

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

NIM-UNI-43fe0159-8
0.311

View
CC(CCc1ccccc1)N1CCN(C(=O)CCl)CC1

MAK-UNK-af83ef51-2
0.310

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

SAD-SAT-f2e2579e-4
0.310

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

SAD-SAT-9a6c5cf3-10
0.309

View
O=C(CCl)N1CCC(c2nc3ccccc3s2)CC1

MAR-TRE-6a44bbf2-53
0.308

View
O=C(CCl)N1CCC(c2nc3ccccc3s2)CC1

MAK-UNK-7c9d1431-25
0.308

View
N#Cc1cccc(CC2CCN(C(=O)CCl)CC2)c1

MAK-UNK-10dfa458-40
0.308

View
CC(=O)OCc1ccc(C2CCN(C(=O)CCl)CO2)cc1

NIM-UNI-43fe0159-10
0.308

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

MAK-UNK-69bf97dd-10
0.308

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

SAD-SAT-29425be4-25
0.308

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

SAD-SAT-29425be4-16
0.307

View
CCc1ccc(CN(Cc2cccnc2)C(=O)C2CCN(C(=O)CCl)CC2)cc1

SAD-SAT-29425be4-27
0.307

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

WAR-XCH-79d12f6e-4
0.307

View
O=C(CCl)N1CCN(S(=O)(=O)Cc2ccccc2)CC1

MAR-TRE-6a44bbf2-28
0.306

View
O=C(CCl)N1CCN(S(=O)(=O)Cc2ccccc2)CC1

MAK-UNK-7c9d1431-23
0.306

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

AAR-POS-0daf6b7e-9
0.304

View
NC(=O)N1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.784

View
CC(=O)N1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.769

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCN(C(=O)N3CCCC3)CC2)cc1

0.755

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CC2)cc1

0.750

View
O=C(NCc1ccccc1)C1CCN(C(=O)CCl)CC1

0.745

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCN(C(=O)NC3CC3)CC2)cc1

0.741

View
CN(C)C(=O)N1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.741

View
CN1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.731

View
CCOC(=O)N1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.727

View
CC(C)C(=O)N1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.727

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCC2)cc1

0.720

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCN(C3CC3)CC2)cc1

0.717

View
CCC(=O)N1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)C1

0.714

View
CCOC(=O)c1ccc(CNC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1

0.696

View
CCNC(=O)C1CCN(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.696

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCC(O)CC2)cc1

0.692

View
COC(=O)c1ccc(CNC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1

0.691

View
CC(C)N1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.691

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCOCC2)cc1

0.679

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCSCC2)cc1

0.679

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2C3CCCC32)cc1

0.679

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCC(NC(=O)C3CC3)CC2)cc1

0.679

View
CS(=O)(=O)N1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.679

View
NS(=O)(=O)N1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.679

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCN(CC(F)(F)F)CC2)cc1

0.679

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)N2CCC(C(=O)NC3CC3)CC2)cc1

0.679

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)N2CCC(C(=O)O)CC2)cc1

0.673

View
CCCNC(=O)C1CCN(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.672

View
C#CCNC(=O)C1CCN(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.672

View
CC(=O)N1CC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)C1

0.667

View
COC(=O)C1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.667

View
C#CCN1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.667

View
CC(C)CN1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.667

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CC=CCC2)cc1

0.667

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCS(=O)(=O)CC2)cc1

0.667

View
COC(=O)[C@H]1CC[C@H](C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.667

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCN(CC(F)F)CC2)cc1

0.667

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)N2CCC(C(=O)O)C2)cc1

0.661

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCC(F)C2)cc1

0.660

View
CCOC(=O)c1ccc(CNC(=O)C2CCN(C(=O)CCc3ccccc3)CC2)cc1

0.655

View
CCS(=O)(=O)N1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.655

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCN(c3ncccn3)CC2)cc1

0.655

View
O=C(CCC(=O)N1CCC(O)CC1)NCc1ccc(C(=O)OCc2ccccc2)cc1

0.655

View
CCOC(=O)c1ccc(CNC(=O)C2CCN(C(=O)OCc3ccccc3)C2)cc1

0.655

View
CNS(=O)(=O)N1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.655

View
COC1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.655

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)N2CCC(O)CC2)cc1

0.655

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CC=CC2)cc1

0.654

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)[C@H]2C[C@@H](O)C2)cc1

0.654

View
O=C(OCc1ccccc1)c1cccc(CNC(=O)C2CCN(C(=O)COc3ccccc3)CC2)c1

0.650

View
COC(=O)c1ccc(CNC(=O)C2CCN(C(=O)OCc3ccccc3)C2)cc1

0.649

View
COC(=O)C1CCN(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.649

View
O=C(CNC(=O)C1CC1)NCc1ccc(C(=O)OCc2ccccc2)cc1

0.648

View
O=C(NCc1ccccc1)C1CCN(C(=O)OCc2ccccc2)CC1

0.647

View
CCOC(=O)c1ccc(CNC(=O)C2CCN(C(=O)COc3ccccc3)CC2)cc1

0.644

View
O=C(OCc1ccccc1)c1cccc(CNC(=O)C2CCN(C(=O)CCc3ccccc3)CC2)c1

0.644

View
NC(=O)c1ccc(CNC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1

0.643

View
NC(=O)C1CCN(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.643

View
CC(=O)C1CCN(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.643

View
O=C1CC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CCN1

0.643

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CC(F)C2)cc1

0.642

View
O=C1CC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)C1

0.642

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)[C@@H]2C[C@@H]3C[C@@H]3C2)cc1

0.642

View
NC(=O)N1CCCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)C1

0.638

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)N2CCC(NC(=O)C3CC3)CC2)cc1

0.638

View
CN1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1=O

0.638

View
O=C(NCc1ccc(Cl)cc1)C1CCN(C(=O)OCc2ccccc2)CC1

0.636

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)[C@H]2C[C@@H]2C2CC2)cc1

0.636

View
O=C(NCCNC(=O)C1CC1)NCc1ccc(C(=O)OCc2ccccc2)cc1

0.636

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CC2C2CC2)cc1

0.636

View
CCC(=O)N1CCCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)C1

0.633

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCCOCC2)cc1

0.632

View
NC(=O)N1CCC(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)CC1

0.632

View
O=C(NO)c1ccc(CNC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1

0.632

View
CNC(=O)c1ccc(CNC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1

0.632

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)N2CCC(CO)CC2)cc1

0.632

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CC2(Cl)Cl)cc1

0.630

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CC(F)(F)C2)cc1

0.630

View
CC1CC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)C1

0.630

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2SCCS2)cc1

0.630

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCCN(C(=O)N3CCCC3)C2)cc1

0.627

View
CC(=O)N1CCCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)C1

0.627

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCCN(C(=O)C3CC3)C2)cc1

0.627

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCN(CC(F)(F)F)C2)cc1

0.627

View
COC(=O)C1CCN(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)C1

0.627

View
O=C1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CN1

0.625

View
O=C1CCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)C1

0.625

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCSC2)cc1

0.625

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCOC2)cc1

0.625

View
O=C(OCc1cccc(Cl)c1)c1ccc(CNC(=O)C2CCCC2)cc1

0.625

View
O=C(COC(=O)c1ccc(CNC(=O)C2CCCC2)cc1)OCc1ccccc1

0.625

View
NC1CCN(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.625

View
O=C(OCc1ccccc1)c1cccc(CNC(=O)C2CCN(C(=O)c3ccc(Cl)cc3)CC2)c1

0.623

View
CCOC(=O)c1ccc(CNC(=O)C2CCN(C(=O)CCOc3ccccc3)CC2)cc1

0.623

View
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C1CCN(C(=O)OCc2ccccc2)CC1

0.621

View
CC(=O)N1CCC(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)CC1

0.621

View
Cc1ccc(CNC(=O)C2CCN(C(=O)CNC(=O)OCc3ccccc3)CC2)cc1

0.621

View
CN1CCCC(C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)C1

0.621

View
[N-]=[N+]=N[C@H]1CC[C@@H](C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.621

View
[N-]=[N+]=N[C@H]1CC[C@H](C(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CC1

0.621

View
COC(=O)c1ccc(COC(=O)c2ccc(CN3CCCC3=O)cc2)cc1

0.196

View
COC(=O)c1ccc(CN(C)C(=O)C2CCN(C(=O)C3CC3)CC2)cc1

0.154

View
COC(=O)c1ccc(CNC(=O)C2CCN(C(=O)C(C)(C)C)CC2)cc1

0.145

View
C(NCC1=CC=C(C(OC)OC)C=C1)(=O)C1CCN(C(C)=O)CC1

0.791

View
C(NCC1=C(C(OC)=O)C=CC=C1)(=O)C1CCN(C(C)=O)CC1

0.765

View
C(N(C(C1CCN(C)CC1)=O)C(C)C)(=O)C1=CC=C(C(OCC)=O)C=C1

0.752

View
C(N(C(C1CCN(CC)CC1)=O)C(C)C)(=O)C1=CC=C(C(OCC)=O)C=C1

0.749

View
C(NCC(OCC1=CC=CC=C1)=O)(=O)C1CCN(C(C2=CC=C(Cl)C=C2)=O)CC1

0.748

View


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