Molecule Details

Molecular Properties
SMILES:
N#Cc1ccc(CNC(=O)N2CCOCC2)cc1
MW: 245.282
Fraction sp3: 0.38
HBA: 3
HBD: 1
Rotatable Bonds: 2
TPSA: 65.36
cLogP: 1.10008
Covalent Warhead: ✔️
Covalent Fragment:
Source
Enamine SCR: Z509756472
Enamine REAL: Z509756472
Enamine Extended REAL: s_2708____5145026____908984
Mcule: MCULE-6404504059
MolPort: MolPort-002-902-739
C#Cc1ccc(CNC(=O)N2CCOCC2)cc1

PAT-GYR-359dbb24-1
0.741

View
O=C(NCc1ccc(C#CBr)cc1)N1CCOCC1

PAT-GYR-359dbb24-2
0.714

View
NC(=O)C#Cc1ccc(CNC(=O)N2CCOCC2)cc1

PAT-GYR-359dbb24-4
0.690

View
COC(=O)C#Cc1ccc(CNC(=O)N2CCOCC2)cc1

PAT-GYR-359dbb24-3
0.656

View
O=C(NCc1ccc(C#Cc2ccccc2)cc1)N1CCOCC1

PAT-GYR-de8eec61-4
0.656

View
O=C(NCc1ccc(C#CCCO)cc1)N1CCOCC1

PAT-GYR-359dbb24-5
0.645

View
N#Cc1ccc(CNC(=O)N2CCN(C(=O)CCl)CC2)cc1

SWA-SYN-6423ea73-7
0.627

View
N#Cc1ccc(CNC(=O)N2CCN(C(=O)CCl)CC2)cc1

SWA-SYN-d2e6fa14-7
0.627

View
O=C(C#Cc1ccc(CNC(=O)N2CCOCC2)cc1)NCc1ccccc1

PAT-GYR-de8eec61-1
0.588

View
N#Cc1ccc(CNC(=O)N2CCOCC2)nc1

PET-SGC-cb83a00c-1
0.581

View
Cc1cccc(C#Cc2ccc(CNC(=O)N3CCOCC3)cc2)c1

PAT-GYR-de8eec61-5
0.571

View
O=C(NCc1ccc(C#Cc2ccccc2CO)cc1)N1CCOCC1

PAT-GYR-de8eec61-7
0.571

View
O=C(C#Cc1ccc(CNC(=O)N2CCOCC2)cc1)NCc1ccc(C(F)(F)F)cc1

PAT-GYR-de8eec61-2
0.563

View
CN(Cc1ccccc1)C(=O)C#Cc1ccc(CNC(=O)N2CCOCC2)cc1

PAT-GYR-de8eec61-3
0.541

View
O=C(NCc1ccc(C#Cc2cccc(CCO)c2)cc1)N1CCOCC1

PAT-GYR-de8eec61-6
0.541

View
CC(=O)NCc1cc(C#N)ccc1CNC(=O)N1CCOCC1

WIL-LEE-1f71e281-1
0.514

View
CC(=O)N1CCN(Cc2cc(C#N)ccc2CNC(=O)N2CCOCC2)CC1

JAN-GHE-fd8d85a5-12
0.468

View
CS(=O)(=O)NCCc1cc(C#N)ccc1CNC(=O)N1CCOCC1

SCO-VAN-260d9628-4
0.468

View
N#Cc1ccc(CNC(=O)CCl)cc1

MAK-UNK-f983951f-23
0.456

View
N#Cc1ccc(CNC(=O)N2CCOCC2)c(CN2CCC(O)CC2)c1

SAD-SAT-f25ee457-4
0.456

View
Cc1nnc(Cc2cc(C#N)ccc2CNC(=O)N2CCOCC2)s1

SAD-SAT-f25ee457-9
0.450

View
N#Cc1ccc(CNC(=O)N2CCOCC2)c(CN2CCN(C(=O)CCl)CC2)c1

TAM-UNI-d1c3dd9f-1
0.444

View
N#Cc1ccc(CNC(=O)N2CCOCC2)c(CN2CCN(C(=O)CCl)CC2)c1

DAR-DIA-fb20be43-16
0.444

View
Cc1ccncc1NC(=O)Cc1cc(C#N)ccc1CNC(=O)N1CCOCC1

PET-SGC-276eba5a-1
0.419

View
N#Cc1ccc(CNC(=O)N2CCOCC2)c(CC(=O)Nc2cccnc2)c1

SAD-SAT-f25ee457-3
0.419

View
O=C(CCl)N1CCN(Cc2cccc(CNC(=O)N3CCOCC3)c2)CC1

TAM-UNI-d1c3dd9f-12
0.416

View
N#Cc1ccc(CNC(=O)N2CCO[C@H](Cc3cc(S(=O)(=O)N4CCN(C(=O)CCl)CC4)ccc3Cl)C2)cc1

PED-UNI-b79f0f51-2
0.411

View
CS(=O)(=O)NCCc1cc(C#N)ccc1NC(=O)N1CCOCC1

ANT-DIA-b7f58f21-9
0.410

View
N#Cc1cnc(CNC(=O)N2CCOCC2)c(CN2CCN(C(=O)CCl)CC2)c1

DAR-DIA-fb20be43-17
0.405

View
N#Cc1ccc(CNC(=O)N2CCOCC2)c2cc(S(N)(=O)=O)ccc12

SAD-SAT-f25ee457-2
0.402

View
N#Cc1ccc(CNC(=O)N2CCOCC2)c(CN2CC3CC2CN3C(=O)CCl)c1

MAK-UNK-ec98eaf6-25
0.396

View
O=C(CC(=O)N1CCOCC1)NCc1ccccc1

GIA-UNK-3f36037a-6
0.382

View
[CH2]C(=O)N1CCN(S(=O)(=O)C2=CC([C@H]3CN(C(=O)NCc4ccc(C#N)cc4)CCO3)C(Cl)=C[CH]2)CC1

PED-UNI-a9f4e7c0-1
0.380

View
N#Cc1ccc(CNC(=O)N2CCOCC2)c(C(c2ccc(Br)s2)N2CCN(C(=O)CCl)CC2)c1

PAU-WEI-f734c343-2
0.379

View
O=C(NCc1cccc(CN2CC3CC2CN3C(=O)CCl)c1)N1CCOCC1

MAK-UNK-10799360-19
0.368

View
CC(NC(=O)CCl)c1ccccc1CNC(=O)N1CCOCC1

TAM-UNI-d1c3dd9f-21
0.367

View
O=C(CCl)N1Cc2ccccc2C(c2cccc(CNC(=O)N3CCOCC3)c2)C1

TAM-UNI-d1c3dd9f-7
0.367

View
N#Cc1ccc(CN/C(=C2/C=CC(C3=NCC(c4ccc(C#N)nc4)CC3)=CN2)N2CCOCC2)cc1

MAK-UNK-9955b1f3-1
0.366

View
N#Cc1cnc(CNC(=O)N2CCOCC2)c([C@@H]2CN(C(=O)CCl)Cc3ccccc32)c1

DAR-DIA-caba39e3-12
0.365

View
N#Cc1ccc(CN2CCN(C(=O)CCl)CC2)cc1

MAK-UNK-6ca90168-14
0.364

View
O=C(NCc1ccccc1)N1CCN(S(=O)(=O)F)CC1

SAD-SAT-2fd372d1-2
0.348

View
CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCc1ccc(C#N)cc1

NIC-BIO-a68395b7-2
0.347

View
O=C(CCl)N1CCN(Cc2cc(Cl)ccc2CNC(=O)N2CCOCC2)CC1

STU-CHA-6cae54d3-1
0.345

View
CC(NCc1ccc(C#N)cc1)C1CCOC1

MAK-UNK-be3f299e-6
0.338

View
N#Cc1ccc(CNC(=O)Cc2c[nH]c3ncccc23)cc1

TRY-UNI-1fd04853-8
0.329

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

MAK-UNK-987948f6-3
0.324

View
N#Cc1ccc(CSCC(=O)O)cc1

MAR-TRE-14ce9fd6-62
0.323

View
N#Cc1ccc(CCCNC(=O)CC(O)O)cc1

NEL-UNI-1464a899-3
0.314

View
O=C(CNC(=O)N1CCN(C(=O)Nc2cccc(Cl)c2)CC1)N1CCOCC1

LUI-IND-a1be81af-2
0.313

View
COc1cnc(CNC(=O)N2CCOCC2)c(CN2CCN(C(=O)CCl)CC2)c1

DAR-DIA-fb20be43-18
0.311

View
O=C(NCc1ccc(Cl)cc1CN1CC2CC1CN2C(=O)CCl)N1CCOCC1

MAK-UNK-10799360-12
0.309

View
CC(=O)NCCc1cn(CC(=O)N2CCOCC2)c2ccc(C#N)cc12

ROB-UNI-b2e39629-12
0.308

View
CS(=O)(=O)NCCc1cc(C#N)ccc1CNC(=O)N1CCCCC1

PET-SGC-0ecb2cfe-1
0.306

View
O=C(CCl)N1CCOCC1

MAK-UNK-f983951f-21
0.304

View
O=C(Cc1ccccc1)Nc1cnccc1CCNC(=O)N1CCOCC1

DAR-DIA-03336633-10
0.300

View
O=C(CCl)N1Cc2ccccc2[C@H](c2cc(F)cnc2CNC(=O)N2CCOCC2)C1

DAR-DIA-caba39e3-13
0.300

View
CC(C)[C@H](NCC#N)C(=O)N1CCOCC1

MAK-UNK-be3f299e-5
0.299

View
O=C(CCl)NCc1ccc(N2CCOCC2)nc1

MAR-TRE-6a44bbf2-67
0.297

View
Cc1ccc(CNC(=O)N2CCCOCCNC(=O)[C@@H]3CCC[C@@H]32)cc1

MAT-POS-ea426761-27
0.297

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(Cl)c(C[C@@H]3CN(C(=O)NCc4ccc([N+](=O)[O-])cc4)CCO3)c2)CC1

PED-UNI-b79f0f51-1
0.288

View
CC(O)CC(=O)NCCCc1ccc(C#N)cc1

NEL-UNI-1464a899-8
0.288

View
N#Cc1ccc(C(N)=O)c(CNC(=O)C2CCOCC2)c1

PHI-UNK-c3ab17cb-1
0.287

View
O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)c1cncnc1

MAR-TRE-8190bb11-7
0.284

View
O=C(CC(=O)N1CCOCC1)Nc1ccccc1

GIA-UNK-3f36037a-2
0.282

View
CC(=O)N1CCN(c2cccc(NC(=O)N3CCOCC3)c2)CC1

WIL-LEE-23e8b574-8
0.278

View
O=C(c1ccc(-c2cncnc2)o1)N1CCOCC1

MAR-TRE-dab8f6ea-29
0.276

View
N#CN1CCN(C(=O)N2CCCOCC2)CC1

JOH-UNI-27ac80fd-17
0.275

View
COc1cccc(CNC(=O)N2CCN(C(=O)N3CCCCC3)CC2)c1

LUI-IND-2c46affe-3
0.274

View
N#CC(C(=O)CN1CCOCC1)c1ccccc1

MAR-TRE-0fda4e82-37
0.270

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

NIM-UNI-43fe0159-8
0.269

View
O=C(NCCN1CCOCC1)C(=O)NCc1ccc2c(c1)OCO2

MAR-TRE-fd17a9b8-7
0.267

View
COc1ccc(NC(=O)CSCc2ccc(C#N)cc2)cc1

MAR-TRE-1c920f6f-97
0.263

View
N#CCNC(=O)c1cc(N2CCOCC2)ccc1S(N)(=O)=O

WIL-NOV-649f4ed0-2
0.262

View
N#Cc1cccc(N(CCN2CCOCC2)C(=O)Nc2cccnc2)c1

JOR-UNI-61e7b1d5-16
0.260

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

SAD-SAT-f2e2579e-10
0.256

View
O=C(NCc1cccnc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1

MAR-TRE-fd17a9b8-62
0.256

View
N#Cc1cccc(CC(=O)Nc2cnccc2CN2CCOCC2)c1

SAD-SAT-24589cd1-6
0.255

View
CCNc1ccc(C#N)cc1C(=O)N1CCN(C(C)=O)CC1

JAN-GHE-fd8d85a5-7
0.253

View
N#Cc1cccc(N(CN2CCOCC2)C(=O)Nc2cccnc2)c1

JOR-UNI-61e7b1d5-3
0.253

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

MAK-UNK-10dfa458-40
0.250

View
CC(Cl)C(=O)N1CCOCC1

MAK-UNK-f983951f-6
0.250

View
N#Cc1ccc(CC(C#N)C(=O)Nc2cccnc2)cc1

MAR-TRE-2fd8122f-69
0.250

View
CCNc1ncc(C#N)cc1N(CN1CCOCC1)C(=O)Nc1cccnc1

JOR-UNI-61e7b1d5-4
0.250

View
N#Cc1ccc(/C=C(/N2CCN(C(=O)CCl)CC2)N2C=CC(=O)CC2=O)cc1

FAB-UNK-7ad5ab26-3
0.250

View
N#Cc1ccc(/C=C/C2=CC(N3CCN(C(=O)CCl)CC3)OC2=O)cc1

FAB-UNK-7ad5ab26-1
0.247

View
N#Cc1ccc(/C=C/C2=CC(N3CCN(C(=O)CCl)CC3)OC2=O)cc1

FAB-UNK-03d90bbc-1
0.247

View
N#Cc1ccc(/C=C/C2=CC(N3CCN(C(=O)CCl)CC3)OC2=O)cc1

FAB-NA_-a03f4448-1
0.247

View
CC(C)(C#N)NC(=O)c1cc(N2CCOCC2)ccc1S(N)(=O)=O

WIL-NOV-649f4ed0-5
0.247

View
N#Cc1ccc(C(=O)N2CCN(S(=O)(=O)/C=C/c3ccccc3)CC2)cc1

TAT-ENA-80bfd3e5-2
0.247

View
Cc1ccc(C(=O)NCCN2CCOCC2)cc1C

MAR-LAB-ca4662a6-5
0.247

View
CC(=O)NCCc1cn(CC(=O)N2CCOCC2)c2ccccc12

DUN-NEW-f8ce3686-13
0.244

View
O=C(Nc1cnn(CC(=O)N2CCOCC2)c1)c1cncnc1

MAR-TRE-c317dd82-7
0.244

View
O=C1CN(c2ccc(CNC(=O)c3cncnc3)cc2)CCN1

MAR-TRE-799db12b-72
0.244

View
O=C(NCCCN1CCOCC1)C(=O)NCc1ccco1

MAR-TRE-fd17a9b8-68
0.244

View
O=C(C1CCCN1C(=O)c1ccccc1)N1CCOCC1

GIA-UNK-d2defdc3-6
0.244

View
N#Cc1ccc(NC(=O)CSc2cnn[nH]2)cc1

MAR-TRE-0fda4e82-11
0.244

View
N#Cc1cccc(CN2CCN(C(=O)CCl)CC2)c1

MAT-POS-ee51dedd-1
0.244

View
O=C(C1CCN(S(=O)(=O)c2ccccc2)CC1)N1CCOCC1

GIA-UNK-eaadd1d4-3
0.244

View
O=C(CC(=O)N1CCOCC1)NC1CCCCC1

GIA-UNK-3f36037a-1
0.243

View
N#Cc1cccc(N(CCN2CCCOCC2)C(=O)Nc2cccnc2)c1

JOR-UNI-61e7b1d5-10
0.243

View
N#CC1=CC=C(CNC(=O)N2CCOCC2)C=C1

1.000

View
N#CC1=CC=C(CNC(=O)N2CCCOCC2)C=C1

0.818

View
N#CC1=CC=C(CNC(=O)N2CCN(C(=O)N3CCOCC3)CC2)C=C1

0.789

View
N#CC1=CC=C(CNC(=O)N2CCN(C(=O)C(=O)N3CCOCC3)CC2)C=C1

0.776

View
N#CC1=CC=C(CNC(=O)N2CCC2)C=C1

0.725

View
N#CC1=CC=C(CNC(=O)N2CCC(C(=O)N3CCOCC3)CC2)C=C1

0.714

View
N#CC1=CC=C(CNC(=O)N2CCCC2)C=C1

0.698

View
N#CC1=CC=C(CNC(=O)N2CCC(CC(=O)N3CCOCC3)CC2)C=C1

0.692

View
CNCC1=CC=C(CNC(=O)N2CCOCC2)C=C1

0.685

View
N#CC1=CC=C(CNC(=O)N2CCN(C(=O)CN3CCOCC3)CC2)C=C1

0.683

View
N#CC1=CC=C(CNC(=O)N2CCCCCC2)C=C1

0.673

View
N#CC1=CC=C(CNC(=O)N2CCCCCCCC2)C=C1

0.673

View
N#CC1=CC=C(CNC(=O)N2CCCCCCC2)C=C1

0.673

View
N#CC1=CC=C(CNCCNC(=O)N2CCOCC2)C=C1

0.672

View
N#CC1=CC=C(CNC(=O)N2CCC(F)CC2)C=C1

0.667

View
O=C(NCC1=CC=C(O)C=C1)N1CCOCC1

0.667

View
N#CC1=CC=C(CNC(=O)N2CCC(CN3CCOCC3)CC2)C=C1

0.662

View
CCC1(N2CCOCC2)CCN(C(=O)NCC2=CC=C(C#N)C=C2)CC1

0.662

View
N#CC1=CC=C(CNC(=O)N2CCC3(CCOCC3)CC2)C=C1

0.661

View
N#CC1=CC=C(CNC(=O)N2CCSSCC2)C=C1

0.661

View
N#CC1=CC=C(CNC(=O)N2CCNCC2)C=C1

0.661

View
CN1CCN(C(=O)NCC2=CC=C(C#N)C=C2)CC1

0.661

View
N#CC1=CC=C(CNC(=O)N2CCSCC2)C=C1

0.661

View
N#CC1=CC=C(CNC(=O)N2CCN(C3=CC=C(C#N)C=C3)CC2)C=C1

0.655

View
NC1=CC=C(CNC(=O)N2CCOCC2)C=C1

0.655

View
CC1=CC=C(CNC(=O)N2CCOCC2)C=C1

0.655

View
O=C(NCC1=CC=C(I)C=C1)N1CCOCC1

0.655

View
CCC1=CC=C(CNC(=O)N2CCOCC2)C=C1

0.655

View
CC(=O)NCC1=CC=C(CNC(=O)N2CCOCC2)C=C1

0.655

View
O=C(NCC1=CC=C(Cl)C=C1)N1CCOCC1

0.655

View
O=C(NCC1=CC=C(F)C=C1)N1CCOCC1

0.655

View
O=C(NCC1=CC=C(Br)C=C1)N1CCOCC1

0.655

View
NCC1=CC=C(CNC(=O)N2CCOCC2)C=C1

0.655

View
N#CC1=CC=C(CNC(=O)N2CCC3(CCO3)CC2)C=C1

0.650

View
N#CC1=CC=C(CNC(=O)N2CCS(=O)(=O)CC2)C=C1

0.649

View
N#CC1=CC=C(CNC(=O)N2CCC(O)CC2)C=C1

0.649

View
N#CC1=CC=C(CCNC(=O)N2CCOCC2)C=C1

0.644

View
N#CC1=CC=C(CNC(=O)C(=O)N2CCOCC2)C=C1

0.644

View
N#CC1=CC=C(CNC(=O)N2CCN(C3CCOCC3)CC2)C=C1

0.641

View
N#CC1=CC=C(CNC(=O)N2CCC3(CC2)OCCO3)C=C1

0.639

View
C=C1CCN(C(=O)NCC2=CC=C(C#N)C=C2)CC1

0.638

View
N#CC1=CC=C(CNC(=O)N2CCC(C3CC3)CC2)C=C1

0.638

View
CCN1CCN(C(=O)NCC2=CC=C(C#N)C=C2)CC1

0.638

View
CC1CCN(C(=O)NCC2=CC=C(C#N)C=C2)CC1

0.638

View
CC1COCCN(C(=O)NCC2=CC=C(C#N)C=C2)C1

0.635

View
N#CC1=CC=C(CNC(=O)N2CCC(CCN3CCOCC3)CC2)C=C1

0.632

View
N#CC1=CC=C(CNC(=O)N2CCCC(N3CCOCC3)CC2)C=C1

0.632

View
CCC1COCCN(C(=O)NCC2=CC=C(C#N)C=C2)C1

0.631

View
N#CC1=CC=C(C(=O)CNC(=O)N2CCOCC2)C=C1

0.627

View
N#CC1=CC=C(CNC(=O)N2CCOCC(O)C2)C=C1

0.625

View
N#CC1=CC(CNC(=O)N2CCOCC2)=CC=C1

0.623

View
N#CC1=CC=C(CN2CCN(C(=O)NCC3=CC=C(C(=O)N4CCOCC4)C=C3)CC2)C=C1

0.620

View
N#CC1=CC=C(CNC(=O)N2CCOC3(CCOCC3)CC2)C=C1

0.618

View
N#CC1=CC=C(CNC(=O)N2CCN(CC3=CC=C(C#N)C=C3)CC2)C=C1

0.617

View
N#CC1=CC=C(CNC(=O)N2CCC3=CC=CC=C3CC2)C=C1

0.617

View
N#CC1=CC=C(CNC(=O)N2CCC(C3CCOC3)CC2)C=C1

0.615

View
N#CC1=CC=C(CNC(=O)N2CCC(CCCN3CCOCC3)CC2)C=C1

0.614

View
N#CC1=CC=C(CNC(=O)N2CC3(CCOCC3)C2)C=C1

0.613

View
N#CC1=CC=C(CNC(=O)NCC2=CC=C(C(=O)N3CCOCC3)C=C2)C=C1

0.609

View
N#CC1=CC=C(CNC(=O)C(=O)NCC2=CC=C(C(=O)N3CCOCC3)C=C2)C=C1

0.609

View
N#CC1=CC=C(CNC(=O)N2CCOCC2)C=C1Cl

0.607

View
N#CC1=CC=C(CNC(=O)N2CCC(C(N)=O)CC2)C=C1

0.607

View
N#CC1=CC=C(CNC(=O)N2CCOCC(F)(F)C2)C=C1

0.606

View
N#CC1=CC=C(CNC(=O)N2CCOCC3(CC3)C2)C=C1

0.606

View
N#CC1=CC=C(CNC(=O)N2CCOC3(CCC3)CC2)C=C1

0.606

View
N#CC1=CC=C(CNC(=O)N2CCN(C3=CC(N4CCOCC4)=NC=N3)CC2)C=C1

0.606

View
N#CC1=CC=C(CNC(=O)CCC(=O)N2CCOCC2)C=C1

0.603

View
N#CC1=CC=C(CNC(=O)N2CCN(CC3CCOCC3)CC2)C=C1

0.603

View
N#CC1=CC=C(CN2CCN(C(=O)NCC3=CC=C(N4CCOCC4)C=C3)CC2)C=C1

0.600

View
N#CC1=CC=C(CNC(=O)N2CCN(C3CCOC3)CC2)C=C1

0.597

View
N#CC1=CC=C(CNC(=O)N2CCN(C(=O)C(=O)N3CCCC3)CC2)C=C1

0.597

View
N#CC1=CC=C(CNC(=O)N2CCN(C(=O)N3CCCC3)CC2)C=C1

0.597

View
N#CC1=CC=C(CNC(=O)N2CCC(C3=CC=C(C#N)C=C3)CC2)C=C1

0.597

View
N#CC1=CC=C(CNC(=O)NCC(=O)N2CCOCC2)C=C1

0.594

View
N#CC1=CC=C(CNC(=O)N2CCC3(CCOC3=O)CC2)C=C1

0.591

View
N#CC1=CC=C(CNC(=O)N2CCOCC3(CCC3)C2)C=C1

0.588

View
N#CC1=CC=C(CNC(=O)N2CCOCC3(CCOCC3)C2)C=C1

0.586

View
CCC1CN(C(=O)NCC2=CC=C(C#N)C=C2)CC1N1CCOCC1

0.586

View
N#CC1=CC=C(CNC(=O)C(=O)NCC(=O)N2CCOCC2)C=C1

0.585

View
N#CC1=CC=C(CNC(=O)C(=O)N2CCN(C(=O)C(=O)N3CCOCC3)CC2)C=C1

0.585

View
N#CC1=CC=C(CNC(=O)N2CC(C3CCOCC3)C2)C=C1

0.585

View
N#CC1=CC=C(CNC(=O)N2CCC3(CCOCC3)C2)C=C1

0.582

View
N#CC1=CC=C(CNC(=O)N2CCC(C3CCOCC3)C2)C=C1

0.582

View
N#CC1=CC=C(CNC(=O)N2CCOC3(CCOCC3)C2)C=C1

0.580

View
N#CC1=CC=C(S(=O)(=O)N2CCN(C(=O)NCC3=CC=C(C(=O)N4CCOCC4)C=C3)CC2)C=C1

0.579

View
N#CC1=CC=C(CNC(=O)N2CCN(C(=O)N3CCCCC3)CC2)C=C1

0.578

View
N#CC1=CC=C(CNC(=O)CN2CCOCC2)C=C1

0.574

View
N#CC1=CC=C(CNC(=O)N2CCOCC3(CCCC3)C2)C=C1

0.571

View
N#CC1=CC=C(CNC(=O)N2CCOCCN2)C=C1

0.569

View
N#CC1=CC=C(CNC(=O)N2CCOC(C3=CC=C(C#N)C=C3)C2)C=C1

0.567

View
N#CC1=CC=C(CNC(=O)C2=CC=C(C(=O)N3CCOCC3)C=C2)C=C1

0.567

View
N#CC1=CC=C(CNC(=O)C(=O)N2CCN(C(=O)N3CCOCC3)CC2)C=C1

0.567

View
N#CC1=CC=C(CNCC(=O)N2CCOCC2)C=C1

0.565

View
N#CC1=CC=C(C(=O)NCC2=CC=C(C(=O)N3CCOCC3)C=C2)C=C1

0.561

View
N#CC1=CC=C(CNC(=O)C(=O)N2CCCOCC2)C=C1

0.561

View
N#CC1=CC=C(CCNC(=O)N2CCCOCC2)C=C1

0.552

View
N#CC1=CC=C(CN2CCN(C(=O)NCC(=O)N3CCOCC3)CC2)C=C1

0.529

View
N#CC1=CC=C(CCNC(=O)N2CCN(C(=O)N3CCOCC3)CC2)C=C1

0.522

View
N#CC1=CC=C(CCNC(=O)N2CCN(C(=O)C(=O)N3CCOCC3)CC2)C=C1

0.514

View
N#CC1=CC=C(CN2CCN(C(=O)NCC3=CC=CC(CN4CCOCC4)=C3)CC2)C=C1

0.500

View
O=C(NCc1ccc(cc1)C#N)N1CCOCC1

1.000

View
O=C(NCc1ccc(cc1)C#C)N1CCOCC1

0.741

View
Cc1ccc(CNC(=O)N2CCOCC2)cc1

0.655

View
Clc1ccc(CNC(=O)N2CCOCC2)cc1

0.655

View
O=C(NCc1ccccc1)N1CCOCC1

0.618

View
O=C(NCc1ccc(CN2CCOCC2)cc1)N1CCOCC1

0.610

View
Cc1cccc(CNC(=O)N2CCOCC2)c1

0.500

View
CCCN(Cc1ccc(cc1)C#N)C(=O)N1CCOCC1

0.464

View
CCOC(C)CN(C)C(=O)NCc1ccc(cc1)C#N

0.356

View
OCCN(Cc1ccccc1)C(=O)NCc1ccc(cc1)C#N

0.347

View
O=C(N(Cc1ccccc1)Cc1ccccc1)N1CCOCC1

0.290

View
CN(Cc1ccccc1)C(=O)N1CCOCC1

0.282

View
CCN(Cc1ccccc1)C(=O)N1CCOCC1

0.278

View


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