Molecule Details

O=C(Cc1c[nH]c2ccccc12)Nc1ccccc1
3-aminopyridine-like Enamine Mcule MolPort
Molecular Properties
SMILES:
O=C(Cc1c[nH]c2ccccc12)Nc1ccccc1
MW: 250.301
Fraction sp3: 0.06
HBA: 1
HBD: 2
Rotatable Bonds: 3
TPSA: 44.89
cLogP: 3.3491
Covalent Warhead:
Covalent Fragment:
Source
Enamine SCR: Z27782686
Enamine REAL: Z27782686
Enamine Extended REAL: s_22____57709____58926
Mcule: MCULE-4404593132
Mcule Ultimate: WGJQECCUBXMMOE-UHFFFAOYSA-N
MolPort: MolPort-002-475-915
O=C(Nc1ccccc1)Nc1cccnc1

AAR-POS-d2a4d1df-11

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CN1CCN(C(=O)Cc2c[nH]c3ncccc23)CC1

AAR-POS-d2a4d1df-20

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O=C(O)CNC(=O)Cc1c[nH]c2ccccc12

MAR-UCB-195bc32d-22
0.603

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O=C(O)CC(NC(=O)Cc1c[nH]c2ccccc12)C(=O)O

MAR-UCB-195bc32d-9
0.556

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CC(=O)NCCc1c[nH]c2ccccc12

SAN-PRS-3c4a6997-2
0.460

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COc1ccc(N(Cc2ccccc2)C(=O)Cc2c[nH]c3ccccc23)cc1

ALP-POS-a3de0cb1-15
0.412

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O=C(Cc1cncc2ccccc12)Nc1ccccc1

DAR-DIA-23aa0b97-20
0.412

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CN(C)CCc1c[nH]c2ccccc12

JOH-MSK-a63bdd1d-10
0.410

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CC(C(=O)O)N(C(=O)Cc1c[nH]c2ccccc12)c1cncnc1

MAR-TRE-85681e92-68
0.408

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CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccccc1

NIC-BIO-3276ca7f-7
0.408

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CC(C)C(C(=O)O)N(C(=O)Cc1c[nH]c2ccccc12)c1cncnc1

MAR-TRE-85681e92-53
0.397

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O=C(O)C(Cc1c[nH]c2ccccc12)Nc1ncccn1

MAR-TRE-f5c2d31c-47
0.397

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NC(CO)Cc1c[nH]c2ccccc12

MAR-UCB-195bc32d-18
0.397

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CC(C)C(NC(=O)Cc1c[nH]c2ccccc12)C(=O)Oc1csc(CCl)n1

MAR-TRE-36bf7dba-26
0.395

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CN(C)C/C=C/C(=O)NCc1c[nH]c2ccccc12

ANT-OPE-ab37bd51-2
0.392

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O=C(CCl)Nc1ccccc1

SAD-SAT-6b5a89f0-8
0.389

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O=C(Cc1c[nH]c2ccccc12)N(Cc1ccccc1)c1ccc(N2CCOCC2)cc1

ALP-POS-8ed8d9ec-6
0.386

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CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC#CBr

NIC-BIO-3276ca7f-2
0.385

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CC(C)CC(NC(=O)Cc1c[nH]c2ccccc12)C(=O)Oc1csc(CCl)n1

MAR-TRE-36bf7dba-27
0.382

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CC(CNC(=O)C(C)Cc1c[nH]c2ccccc12)Cc1ccccc1

CUN-WAB-25b584ee-1
0.380

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CCC(C)C(C(=O)O)N(C(=O)Cc1c[nH]c2ccccc12)c1cncnc1

MAR-TRE-85681e92-69
0.378

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CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)Nc1cccnc1

MAR-TRE-74c6519b-79
0.378

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CCC(C)C(NC(=O)Cc1c[nH]c2ccccc12)C(=O)Oc1csc(CCl)n1

MAR-TRE-36bf7dba-21
0.378

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CC(C)n1ncc2cc(NC(=O)CCc3c[nH]c4ccccc34)cnc21

MAR-TRE-b77b7921-67
0.367

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O=C(CC(=O)Nc1ccncc1)Nc1ccccc1

GIA-UNK-3f36037a-7
0.367

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N#CCSCC(=O)Nc1ccccc1

MAR-TRE-14ce9fd6-61
0.365

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CN(c1cncnc1)C(Cc1c[nH]c2ccccc12)C(=O)O

MAR-TRE-85681e92-33
0.364

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Cc1ccc(S(=O)(=O)NC(=O)NCCc2c[nH]c3ccccc23)cc1

MAR-TRE-fd17a9b8-35
0.362

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O=C(Cn1c(=O)[nH]c2ccccc2c1=O)NCCc1c[nH]c2ccccc12

MAR-TRE-fd17a9b8-10
0.357

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O=C(Cc1c[nH]c2ncccc12)Nc1cccnc1

KAL-WAB-eb347ebe-1
0.356

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CNC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)c1cncnc1

MAR-TRE-4f781e27-6
0.354

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CC(Cc1c[nH]c2ccccc12)C(=O)NCC(C)C(Cc1ccccc1)c1ccccc1

SUN-WAB-e274cdaf-1
0.352

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NCCc1ccncc1CC(=O)Nc1ccccc1

DAR-DIA-03336633-15
0.352

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Cn1ccn(C(Cc2c[nH]c3ccccc23)C(=O)O)c1=[Au+]Cl

MAR-TRE-4f39ef4a-5
0.350

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O=C(Cc1csc(-c2ccccc2F)n1)NCCc1c[nH]c2ccccc12

MAR-TRE-fd17a9b8-18
0.348

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O=C(O)NC(=O)Cc1c[nH]c2ccc(F)cc12

ABI-SAT-30e287c1-2
0.343

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COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)c1cncnc1

MAR-TRE-4f781e27-69
0.341

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COc1ccc(N(Cc2ccoc2)C(=O)Cc2c[nH]c3ccccc23)cc1

ALP-POS-8ed8d9ec-2
0.341

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CC(C)Cn1cc(NC(=O)NCCc2c[nH]c3ccccc23)c2ccccc2c1=O

LON-WEI-4d77710c-20
0.341

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O=C(N[C@H]1CCN2C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)[C@H]12)c1ccccc1

BRU-UNI-248b30bc-12
0.340

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O=C(CNC(=O)c1c[nH]c2ccccc12)Nc1cccnc1

MAR-TRE-74c6519b-68
0.338

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COC(=O)C(Cc1c[nH]c2ccccc12)n1ccn(C)c1=[Au+]Cl

MAR-TRE-4f39ef4a-9
0.337

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O=C(CN1CCNCC1)Nc1ccccc1

WIL-LEE-23e8b574-6
0.333

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O=C(CCl)CNC(=O)CC(=O)Nc1ccccc1

GIA-UNK-3f36037a-4
0.333

View
O=C(Nc1cccnc1)[C@H]1CCCN(C(=O)CCc2c[nH]c3ccccc23)C1

MAR-TRE-f6f5f473-6
0.330

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O=C(Cc1c[nH]c2ncccc12)Nc1cccc(Cl)c1

DAR-DIA-23aa0b97-12
0.329

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CC(C)C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN(N)Cc1ccccc1)C(=O)O

YIA-UNI-71f25a82-2
0.323

View
N[C@H](Cc1c[nH]c2ccccc12)C(=O)NN(Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O

YIA-UNI-71f25a82-1
0.323

View
O=C(CCl)N1CCN(c2c(F)cc(N(CC3CC3)C(=O)Cc3c[nH]c4ccccc34)cc2F)CC1

NIM-UNI-310206f0-31
0.316

View
O=C(CCl)N1CCN(c2c(F)cc(N(C(=O)Cc3c[nH]c4ccccc34)c3ncccn3)cc2F)CC1

NIM-UNI-310206f0-49
0.316

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O=C(Cc1ccccc1)Nc1cccnc1

SAN-PRS-52b81272-2
0.313

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N#Cc1cccc(NC(=O)Cc2c[nH]c3ncccc23)c1

DAR-DIA-23aa0b97-1
0.313

View
COc1cc(NC(=O)Cc2c[nH]c3ncccc23)cc(OC)c1

MAR-TRE-3159af1a-33
0.312

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O=C(CNC(=O)c1cncnc1)Nc1ccccc1

MAR-TRE-4f781e27-49
0.310

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CCNc1ncc(C#N)cc1NCc1c[nH]c2ccccc12

GAB-REV-df64cf17-18
0.310

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O=C(Nc1ccccc1)c1ccccc1O

CLI-UNI-032f7715-2
0.306

View
N=C(N)NCCC[C@H](NC(=O)[C@@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CO)C(=O)O

SAL-INS-68b48d12-9
0.306

View
Nc1nc2c(s1)CN(C(=O)CCc1c[nH]c3ccccc13)CC2

MAT-POS-ea426761-94
0.304

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

GIA-UNK-3f36037a-2
0.300

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CCN(Cc1ccc(OC)c(F)c1)C(=O)C(Cc1c[nH]c2ccccc12)NC(C)=O

NJA-MAN-b9fb953f-5
0.299

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CC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)C(=O)N[C@@H](CCCNC(N)=O)C(N)=O

SAL-INS-68b48d12-10
0.299

View
CN(C)C/C=C/C(=O)Nc1c[nH]c2ccccc12

ANT-OPE-ab37bd51-1
0.299

View
N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CO)C(=O)O

SAL-INS-68b48d12-7
0.297

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CC(Br)NC(=O)Nc1ccccc1

MAX-MCD-16e3709a-1
0.295

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O=C(Nc1ccccc1)c1cccc2[nH]c(NCc3ccccc3O)nc12

SWA-SYN-40d44a84-3
0.294

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N#Cc1ccccc1NC(=O)Cc1c[nH]c2ncccc12

ANT-DIA-3c79be55-1
0.293

View
O=C(Cc1nnc(O)c2ccccc12)Nc1cccnc1

MAR-TRE-74c6519b-55
0.291

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N#Cc1cncc(NC(=O)Cc2c[nH]c3ncccc23)c1

DAR-DIA-23aa0b97-2
0.291

View
O=C(Nc1ccccc1)Nc1ccc(C(=O)NCCc2c[nH]c3ccc(F)cc23)nc1

MAK-UNK-37f1d6fa-2
0.290

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O=C(Cc1cnccc1CCNC(=O)NC1CCCCC1)Nc1ccccc1

DAR-DIA-03336633-2
0.289

View
CC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=O)C(N)=O

SAL-INS-68b48d12-6
0.288

View
N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CO)C(=O)O

SAL-INS-68b48d12-5
0.288

View
O=C(Nc1ccccc1)c1ccccc1

CHR-SOS-7098f804-9
0.288

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Cc1ccncc1NC(=O)CNc1c[nH]c2ccccc12

GAB-REV-70cc3ca5-17
0.286

View
O=C(Cc1ccccc1C(=O)O)Nc1cccnc1

MAK-UNK-a7b37c5e-2
0.284

View
CC(C)(C)c1cc(C(C)(C)C)c(NC(=O)c2c[nH]c3ccccc3c2=O)cc1O

MAR-UCB-195bc32d-45
0.282

View
N#Cc1cccnc1SCC(=O)Nc1ccccc1

MAR-TRE-1c920f6f-42
0.282

View
Cc1nc(NCC2CCCO2)sc1C(=O)NCCc1c[nH]c2ccccc12

MAR-TRE-fd17a9b8-25
0.282

View
COCCOc1ncccc1NC(=O)Cc1c[nH]c2ccc(F)cc12

MAR-TRE-7f7bb9f0-83
0.280

View
CC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCNC(N)=O)C(N)=O

SAL-INS-68b48d12-8
0.279

View
O=C(Nc1ccccc1)Nc1cncc(C(=O)NCCc2c[nH]c3ccc(F)cc23)c1

MAK-UNK-37f1d6fa-3
0.278

View
Cc1ccc2[nH]cc(CCC(=O)NCC(=O)Nc3cccnc3)c2c1

MAR-TRE-04c86cea-51
0.278

View
O=C(NCC(c1ccccc1)c1c[nH]c2ccccc12)c1cncnc1

MAR-TRE-9d18ae8c-91
0.276

View
O=C(NCC(=O)c1c[nH]c2ccccc12)c1cncnc1

MAR-TRE-4f781e27-96
0.275

View
O=C(Cc1ccccc1Cl)Nc1cccnc1

MAK-UNK-a7b37c5e-1
0.274

View
O=C(Nc1ccccc1)Nc1cccnc1

AAR-POS-d2a4d1df-11
0.273

View
CS(=O)(=O)NCc1c[nH]c2c(CC(=O)Nc3ccncc3)cc(F)cc12

TAM-UNI-c140e31a-20
0.273

View
Cc1[nH]c2ccccc2c1[C@H]1c2ccccc2C(=O)N1CCC(=O)Nc1cccnc1

MAR-TRE-04c86cea-87
0.272

View
O=C(Cc1cccc(Cl)c1)Nc1n[nH]c2ccccc12

EDJ-MED-c8e7a002-11
0.272

View
O=C(NC(C(=O)O)c1c[nH]c2ccccc12)c1cncnc1

MAR-TRE-8190bb11-25
0.272

View
O=C(CCl)N1CCN(C(=O)Nc2ccccc2)CC1

AHN-SAT-de2502ba-7
0.271

View
O=C(Nc1ccccc1)c1cc(Cl)ccc1O

CHR-SOS-7098f804-7
0.271

View
COc1ccc(Cl)cc1CC(=O)Nc1cc(=O)[nH]c2ccccc12

MAT-POS-e1b5ac6b-2
0.270

View
COc1ccc(Cl)cc1CC(=O)Nc1cc(=O)[nH]c2ccccc12

MAT-POS-3b92565d-4
0.270

View
O=C(Nc1ccccc1)Nc1cncc2[nH]ccc12

SID-ELM-2583a2cd-8
0.269

View
O=C(Nc1ccccc1)Nc1cncc2[nH]ncc12

SID-ELM-2583a2cd-10
0.269

View
O=C(NCCNc1ccccc1)c1cc(=O)[nH]c2ccccc12

BEN-DND-7e92b6ca-4
0.268

View
O=C(Cc1cnc(O)c2ccccc12)Nc1cccc(Cl)c1

MIC-UNK-66895286-5
0.268

View
O=C(Cc1cncnc1)Nc1cccc(CCCc2ccccc2)c1

BAR-COM-4e090d3a-11
0.268

View
O=C(Cn1c(=O)[nH]c2ccccc2c1=O)NCCc1c[nH]c2ccc(Cl)cc12

MAR-TRE-fd17a9b8-1
0.268

View
O=C(NCCNC(=O)C1CCCO1)c1c[nH]c2ccccc12

MAR-TRE-fd17a9b8-29
0.267

View
O=C(CCNC(=O)c1c[nH]c2ccccc12)Nc1ccc(-n2cnc3ccccc32)cc1

IAN-BAS-5394d4c4-1
0.267

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccccc1

1.000

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(NC(=O)Nc2ccccc2)cc1

0.889

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(NC(=O)Nc2ccccc2)c1

0.821

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(C(=O)Nc2ccccc2)cc1

0.821

View
O=C(Cc1c[nH]c2ccccc12)NCC(=O)Nc1ccccc1

0.816

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(I)cc1

0.789

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(O)cc1

0.789

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(Cl)cc1

0.789

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(F)cc1

0.789

View
Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.789

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(Br)cc1

0.789

View
CC(=O)Nc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.789

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccncc1

0.789

View
NC(=O)Nc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.789

View
CCC(=O)Nc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.789

View
Nc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.789

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1

0.780

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(CNc2ccccc2)cc1

0.780

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccccc1NC(=O)Nc1ccccc1

0.775

View
O=C(Cc1c[nH]c2ccccc12)NCCC(=O)Nc1ccccc1

0.775

View
O=C(Cc1c[nH]c2ccccc12)NNC(=O)Nc1ccccc1

0.769

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(C(=O)O)cc1

0.769

View
O=C(CCc1c[nH]c2ccccc12)Nc1ccccc1

0.757

View
N#Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.750

View
COCC(=O)Nc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.750

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(S(=O)(=O)F)cc1

0.750

View
NC(=O)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.750

View
CCc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.750

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(I)c1

0.750

View
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccccc1

0.750

View
CC(=O)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.750

View
O=C(O)Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.750

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccsc1

0.744

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(NC(=O)c2ccccc2)c1

0.738

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(C(=O)c2ccccc2)c1

0.738

View
O=C(Cc1c[nH]c2ccccc12)NNc1ccccc1

0.737

View
O=C(Cc1c[nH]c2ccccc12)NNC(=S)Nc1ccccc1

0.732

View
Cc1cccc(NC(=O)Cc2c[nH]c3ccccc23)c1

0.732

View
CC(C)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.732

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(C(F)(F)F)cc1

0.732

View
CS(=O)(=O)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.732

View
CC(C)CC(=O)Nc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.732

View
COC(=O)Nc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.732

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(C2CC2)cc1

0.732

View
NS(=O)(=O)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.732

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(Cl)c1

0.732

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(F)c1

0.732

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccnc1

0.732

View
CSc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.732

View
CS(=O)(=O)Nc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.732

View
CS(=O)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.732

View
CN(C)CC(=O)Nc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.732

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(NC(=O)CC(F)(F)F)cc1

0.732

View
CN(C)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.732

View
COc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.732

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(Br)c1

0.732

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(O)c1

0.732

View
CC(=O)Nc1cccc(NC(=O)Cc2c[nH]c3ccccc23)c1

0.732

View
NC(=O)Nc1cccc(NC(=O)Cc2c[nH]c3ccccc23)c1

0.732

View
NC(=O)Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.732

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(-n2nccn2)cc1

0.732

View
O=C(COC(=O)Cc1c[nH]c2ccccc12)Nc1ccccc1

0.732

View
Nc1cccc(NC(=O)Cc2c[nH]c3ccccc23)c1

0.732

View
CC(C)(C)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.732

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1

0.727

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(NS(=O)(=O)c2ccccc2)c1

0.727

View
O=C(Cc1c[nH]c2ccccc12)Nc1cc(Cl)cc(Cl)c1

0.725

View
O=C(Cc1c[nH]c2ccccc12)Nc1cncnc1

0.725

View
O=C(Cc1c[nH]c2ccccc12)Nc1cc(F)cc(F)c1

0.725

View
Cc1cc(C)cc(NC(=O)Cc2c[nH]c3ccccc23)c1

0.725

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(OC(F)F)cc1

0.721

View
O=C(CCCc1c[nH]c2ccccc12)Nc1ccccc1

0.718

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc([N+](=O)[O-])cc1

0.714

View
CNC(=O)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.714

View
CCCc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.714

View
CNC(=O)Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.714

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(NC(=O)C2CC2)cc1

0.714

View
CS(=O)(=O)Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.714

View
O=C(Cc1c[nH]c2ccccc12)NNC(=O)Cc1c[nH]c2ccccc12

0.714

View
CNS(=O)(=O)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.714

View
NS(=O)(=O)Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.714

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(CCO)cc1

0.714

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(-c2ccc[nH]2)cc1

0.714

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(-n2c(=O)[nH][nH]c2=O)cc1

0.714

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(N2CCCC2)cc1

0.714

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(C(=O)O)c1

0.714

View
O=C(COc1cccc(NC(=O)Cc2c[nH]c3ccccc23)c1)Nc1ccccc1

0.711

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(S(=O)(=O)Nc2ccccc2)c1

0.711

View
O=C(Cc1c[nH]c2ccc(F)cc12)Nc1ccccc1

0.707

View
O=C(Cc1c[nH]c2cc(F)ccc12)Nc1ccccc1

0.707

View
O=C(Cc1c[nH]c2cc(Cl)ccc12)Nc1ccccc1

0.707

View
O=C(Cc1c[nH]c2cnccc12)Nc1ccccc1

0.707

View
Cc1ccc2c(CC(=O)Nc3ccccc3)c[nH]c2c1

0.707

View
O=C(Cc1c[nH]c2cc(Br)ccc12)Nc1ccccc1

0.707

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc2ccccc2c1

0.707

View
O=C(Cc1c[nH]c2ccccc12)Nc1cc(F)c(F)c(F)c1

0.707

View
O=C(Cc1c[nH]c2ccccc12)Nc1cn[nH]c1

0.707

View
O=C(Cc1c[nH]c2ccc(Cl)cc12)Nc1ccccc1

0.707

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(S(=O)(=O)F)c1

0.705

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(OCc2ccccc2)cc1

0.705

View
CC(=O)c1ccc(NC(=O)C(=O)c2c[nH]c3ccccc23)cc1

0.156

View
Cc1cc(C)cc(NC(=O)C(=O)c2c[nH]c3ccccc23)c1

0.156

View
Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)c(Br)c1

0.156

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(SC(F)F)cc1

0.156

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(CN2CCCC2)cc1

0.156

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(Oc2ccccc2)cc1

0.156

View
CCc1ccc(NC(=O)C(=O)c2c[nH]c3ccccc23)cc1

0.151

View
Cc1cccc(NC(=O)C(=O)c2c[nH]c3ccccc23)c1

0.151

View
CCOc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.151

View
Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)c(F)c1

0.151

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(Br)cc1Br

0.151

View
CCn1c2ccccc2c2cc(NC(=O)Cc3c[nH]c4ccccc34)ccc21

0.151

View
Cc1[nH]c2ccccc2c1CC(=O)Nc1ccc(Nc2ccccc2)cc1

0.151

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccccc1NCC(F)(F)F

0.151

View
CN(C)CC(=O)Nc1cccc(NC(=O)Cc2c[nH]c3ccccc23)c1

0.151

View
CC(=O)Nc1ccc(NC(=O)C(=O)c2c[nH]c3ccccc23)cc1

0.147

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(F)cc1F

0.147

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(N2CCCCCC2)cc1

0.147

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc2ncccc12

0.147

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(NC(=O)C2CC2)c1

0.147

View
CC(=O)c1ccccc1NC(=O)Cc1c[nH]c2ccccc12

0.147

View
Cc1cc(F)ccc1NC(=O)Cc1c[nH]c2ccccc12

0.147

View
Cc1ccc(NC(=O)C(=O)c2c[nH]c3ccccc23)cc1

0.142

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(F)c(F)c1

0.142

View
Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)c(Cl)c1

0.142

View
Cc1cc(C)cc(NC(=O)Cc2c(C)[nH]c3ccccc23)c1

0.142

View
CCc1cccc(NC(=O)Cc2cn(C)c3ccccc23)c1

0.142

View
O=C(O)C=Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.142

View
CCN1CCN(c2ccc(NC(=O)Cc3c[nH]c4ccccc34)cc2)CC1

0.142

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(C(F)(F)F)c1

0.137

View
CN1CCN(c2ccc(NC(=O)Cc3c[nH]c4ccccc34)cc2)CC1

0.137

View
CCN(CC)C(=O)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.137

View
CC(C)c1ccc(NC(=O)Cc2cn(C)c3ccccc23)cc1

0.137

View
O=C(O)Cc1cccc(NC(=O)Cc2c[nH]c3ccccc23)c1

0.137

View
Cn1cc(CC(=O)Nc2ccc(C(C)(C)C)cc2)c2ccccc21

0.137

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc([N+](=O)[O-])cc1

0.137

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(CC(=O)NC2CC2)cc1

0.137

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccnc1

0.136

View
Cc1cc(NC(=O)Cc2c[nH]c3ccccc23)ccc1Br

0.133

View
Cc1cc(Cl)ccc1NC(=O)Cc1c[nH]c2ccccc12

0.133

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(C(=O)O)cc1

0.133

View
CCCCN(C(=O)Cc1c[nH]c2ccccc12)c1ccccc1

0.133

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(-n2cccc2)cc1

0.133

View
CSc1ccccc1NC(=O)Cc1c[nH]c2ccccc12

0.128

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(N2CCCCC2)cc1

0.128

View
O=C(Cc1c[nH]c2ccccc12)Nc1cc(F)cc(F)c1

0.128

View
Cc1cc(N(C)C)ccc1NC(=O)Cc1c[nH]c2ccccc12

0.128

View
Cc1cccc(C(C)C)c1NC(=O)Cc1c[nH]c2ccccc12

0.128

View
NC(=O)Cc1ccccc1NC(=O)Cc1c[nH]c2ccccc12

0.128

View
O=C(Nc1ccccc1)C(=O)c1c[nH]c2ccccc12

0.123

View
COc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.123

View
CCc1ccc(NC(=O)Cc2cn(C)c3ccccc23)cc1

0.123

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(F)c1

0.118

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(Cl)c1

0.118

View
COC(=O)Nc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.118

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccncc1

0.118

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(I)c1

0.113

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccccc1O

0.113

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(C(F)(F)F)cc1

0.113

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccccc1F

0.113

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(Br)c1

0.108

View
CNC(=O)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.108

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(-c2ccccc2)cc1

0.108

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccccc1Br

0.108

View
Cc1cccc(NC(=O)Cc2c[nH]c3ccccc23)c1C

0.103

View
N#Cc1cccc(NC(=O)Cc2c[nH]c3ccccc23)c1

0.098

View
CCc1cccc(C)c1NC(=O)Cc1c[nH]c2ccccc12

0.098

View
C#Cc1cccc(NC(=O)Cc2c[nH]c3ccccc23)c1

0.098

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(CO)c1

0.098

View
Cc1ccc(C)c(NC(=O)Cc2c[nH]c3ccccc23)c1

0.092

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(Br)cc1

0.092

View
CSc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.092

View
CNC(=O)Nc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.092

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccccc1I

0.092

View
Cn1cc(CC(=O)Nc2ccccc2)c2ccccc21

0.087

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(F)cc1

0.087

View
Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)c(C)c1

0.087

View
CC(=O)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.087

View
CC(C)c1cccc(NC(=O)Cc2c[nH]c3ccccc23)c1

0.087

View
CC(=O)Nc1cccc(NC(=O)Cc2c[nH]c3ccccc23)c1

0.082

View
NC(=O)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.082

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(Cl)cc1

0.082

View
CCc1ccccc1NC(=O)Cc1c[nH]c2ccccc12

0.082

View
Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1C

0.076

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(I)cc1

0.076

View
CCCc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.076

View
N#Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.071

View
CCc1cccc(NC(=O)Cc2c[nH]c3ccccc23)c1

0.065

View
CC(C)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.060

View
Cc1cccc(C)c1NC(=O)Cc1c[nH]c2ccccc12

0.060

View
CC(C)(C)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.060

View
Cc1ccccc1NC(=O)Cc1c[nH]c2ccccc12

0.054

View
O=C(Cc1c[nH]c2ccccc12)Nc1cccc2ccccc12

0.054

View
CC(C)C(=O)Nc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.054

View
Cc1cc(C)cc(NC(=O)Cc2c[nH]c3ccccc23)c1

0.043

View
O=C(Cc1c[nH]c2ccccc12)Nc1ccc2ccccc2c1

0.043

View
CN(C(=O)Cc1c[nH]c2ccccc12)c1ccccc1

0.043

View
CC(=O)Nc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.031

View
Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1

0.031

View
C(NC1=CC=CC=C1)(=O)CC1C2=C(C=CC=C2)NC=1

1.000

View
C(NC1=CC=C(C)C=C1)(=O)CC1C2=C(C=CC=C2)NC=1

0.966

View
C(NC1C=CC=C(C)C=1)(=O)CC1C2=C(C=CC=C2)NC=1

0.956

View
C(NC1=CC=C(CC)C=C1)(=O)CC1C2=C(C=CC=C2)NC=1

0.948

View
C(NC1=CC=C(F)C=C1)(=O)CC1C2=C(C=CC=C2)NC=1

0.943

View

Discussion: