Molecule Details

O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(Cc2ccncc2)C1
Mcule MolPort
Molecular Properties
SMILES:
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(Cc2ccncc2)C1
MW: 377.15
Fraction sp3: 0.25
HBA: 5
HBD: 2
Rotatable Bonds: 5
TPSA: 108.05
cLogP: 0.98
Covalent Warhead:
Covalent Fragment:
Source
Mcule: MCULE-3992165986
MolPort: MolPort-028-588-305

O=C(NCc1nc2ccccc2c(=O)[nH]1)C(c1cccnc1)N1CCCC1

MAR-TRE-c8530538-71
0.419

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CN(CC(=O)NCc1nc2ccccc2c(=O)[nH]1)Cc1cccnc1

MAR-TRE-c8530538-92
0.416

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COc1ccc(CN2CC(C(=O)Nc3cccnc3)CC2=O)cc1

MAR-TRE-2fd8122f-64
0.379

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CCNC(=O)c1ccc(NCc2nc3ccccc3c(=O)[nH]2)nc1

MAR-TRE-c8530538-26
0.365

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O=C(NCCc1nc2ccccc2c(=O)[nH]1)C(c1cccnc1)N1CCCC1

MAR-TRE-c8530538-10
0.354

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CCOc1ncccc1C(=O)NCCc1nc2ccccc2c(=O)[nH]1

MAR-TRE-c8530538-97
0.352

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CCC(=O)NCCC(=O)N(Cc1ccccc1)Cc1nc2ccccc2c(=O)[nH]1

JUA-UNI-b93289a4-5
0.336

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C=CC(=O)NCCC(=O)N(Cc1ccccc1)Cc1nc2ccccc2c(=O)[nH]1

JUA-UNI-a9dfaed1-5
0.330

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CC(Sc1ccccn1)C(=O)NCCc1nc2ccccc2c(=O)[nH]1

MAR-TRE-c8530538-50
0.321

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CCNC(=O)c1ccc(NCCc2nc3ccccc3c(=O)[nH]2)nc1

MAR-TRE-c8530538-16
0.318

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Cc1cccn2c(CC(=O)N(C)Cc3nc4ccccc4c(=O)[nH]3)cnc12

MAR-TRE-c8530538-73
0.316

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O=C(c1nc2ccccc2c(=O)[nH]1)N1CC(O)C(Cc2ccccn2)C1

MAR-TRE-c8530538-68
0.312

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CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1cnn2ccccc12

MAR-TRE-c8530538-86
0.292

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CN(Cc1nc2ccccc2c(=O)[nH]1)c1nccc(-c2cccnc2)n1

MAR-TRE-c8530538-55
0.286

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CC(C)C(NC(=O)c1nc2ccccc2c(=O)[nH]1)c1cccnc1

MAR-TRE-c8530538-76
0.284

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CCc1nc(C)c(CC(=O)NCCc2ccncc2)c(=O)[nH]1

MAR-TRE-c8530538-90
0.279

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N#CCNC(=O)C1CC(=O)N(CCc2ccc(F)cc2)C1

MAR-TRE-0fda4e82-16
0.276

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COc1ccc(CCN2CC(C(=O)Nc3cccnc3)CC2=O)cc1OC

MAR-TRE-2fd8122f-74
0.271

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N#Cc1ccc(CSc2nc3ccccc3c(=O)[nH]2)cc1

MAR-TRE-14ce9fd6-13
0.269

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N#Cc1cnc(SCc2nc3ccccc3c(=O)[nH]2)nc1N

MAR-TRE-a3327163-9
0.266

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CCN1C[C@H](C(=O)Nc2ccc(N)nc2)CC1=O

MAR-TRE-7f7bb9f0-86
0.255

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O=C(Cn1c(=O)n(Cc2ccncc2)c(=O)c2ncccc21)NCc1ccccc1

MAR-TRE-4b834d9a-52
0.254

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O=C(CNC(=O)c1cncnc1)NCc1ccncc1

MAR-TRE-e82e6c98-54
0.253

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O=C(CCl)N1CCC(c2nc(-c3cccnc3)nc3ccccc23)CC1

WAR-XCH-b0339bbe-19
0.250

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O=C(CCl)N1CC2CC1CC2c1nc(-c2cccnc2)nc2ccccc12

MAK-UNK-5d2caa6f-11
0.250

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CCCN1CC(C(=O)NCC#N)CC1=O

MAR-TRE-6c5ef77a-42
0.250

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O=C1CC(Oc2cc(Cl)cc(C(CCc3ccccc3)C(=O)Nn3cnc4ccccc43)c2)N1

MAT-POS-c478e61b-2
0.248

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O=C(CCl)N1CC2CC(c3nc(-c4cccnc4)nc4ccccc34)C1C2

MAK-UNK-5d2caa6f-9
0.246

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

LON-WEI-120e5cf5-14
0.245

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NC(=O)[C@H]1CN(Cc2ccncc2)C[C@H]1c1ccsc1

ANN-UNI-26382800-7
0.245

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O=C(Nc1cc(Cl)nc2ccccc12)C1CC2CC1CN2C(=O)CCl

MAK-UNK-5d2caa6f-13
0.243

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O=C(NCCN1CC(C(=O)O)CC1=O)c1cncnc1

MAR-TRE-e82e6c98-22
0.243

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O=C(CCl)N1CCCC(c2nc(-c3cccnc3)nc3ccccc23)C1

WAR-XCH-bdd24732-16
0.242

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COc1cc(CNC(=O)Cc2ncc[nH]2)c2ccccc2n1

BAR-COM-4e090d3a-22
0.241

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O=C(CCl)N1CCN(Cc2cccc3ccccc23)CC1Cc1cccnc1

MIH-UNI-e573136b-3
0.240

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COc1ccc(CCN2C[C@H](C(=O)Nc3ccc(N)nc3)CC2=O)cc1OC

MAR-TRE-4b834d9a-58
0.238

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O=C(Cn1c(=O)n(Cc2ccncc2)c(=O)c2ncccc21)NCc1ccc(F)cc1

MAR-TRE-d0525fbf-1
0.238

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Cc1nc2c(cc1C(=O)OC(C)C)c(=O)[nH]c(=O)n2Cc1ccccc1

MAT-POS-b5746674-131
0.237

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COCCN1C[C@H](C(=O)Nc2ccc(N)nc2)CC1=O

MAR-TRE-7f7bb9f0-67
0.236

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O=C(NCc1coc2ccccc12)C1CCc2nnc(-c3ccc(O)cc3)n2C1

ERI-BAS-37e2bb46-1
0.236

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O=C(Cn1c(=O)n(Cc2ccncc2)c(=O)c2ncccc21)NCc1ccccc1Cl

MAR-TRE-d0525fbf-29
0.236

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O=C(NCCc1ccncc1)c1ccccc1F

AAR-POS-d2a4d1df-10
0.235

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O=C1CC(Oc2cc(Cl)cc(CC(=O)Nn3cnc4ccccc4c3=O)c2)N1

JAN-GHE-74b8b0cb-1
0.234

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Cc1c(CC(=O)Nc2cncc3ccccc23)cc(Cl)cc1OC1CC(=O)N1

EDJ-MED-50011917-2
0.232

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O=C(Nc1nncn1C1CC1)c1cccc2ccccc12

ANT-OPE-bf404da3-1
0.231

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CCCC(C(=O)Nn1cnc2ccccc2c1=O)c1cc(Cl)cc(OC2CC(=O)N2)c1

JAN-GHE-74b8b0cb-2
0.231

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O=C(CCc1nc(O)c2ccccc2n1)Nc1ccc(Cl)nc1

MAR-TRE-3e4e6814-31
0.230

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O=C(NCCc1ccncc1)NC1CCCCC1

AAR-POS-d2a4d1df-12
0.230

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O=C(NCc1cccc(C(=O)N2CCOCC2)c1)c1cnc2c(c1)c(=O)[nH]c(=O)n2Cc1ccccc1

IAN-BAS-647c7407-1
0.230

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CCCCc1nc(-c2c(-c3ccccc3)ncn2Cc2ccncc2)c[nH]1

MAT-POS-ea426761-75
0.229

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NC(=O)C1CCN(c2nc(NCCCO)c3ccccc3n2)CC1

MAR-TRE-f5c2d31c-23
0.228

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COC(=O)c1cc2c(=O)[nH]c(=O)n(CCc3ccccc3)c2nc1C

MAT-POS-b5746674-136
0.228

View
Cc1ccc(CNC(=O)Cn2c(=O)n(Cc3ccncc3)c(=O)c3ncccc32)cc1

MAR-TRE-3e4e6814-11
0.228

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O=C(Cn1cnc2ccccc2c1=O)NCCc1c[nH]c2ccc(Cl)cc12

MAR-TRE-fd17a9b8-41
0.228

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O=C(NCc1ccccc1Cl)C1CCN(CCc2c[nH]c3ncccc23)CC1

MAR-TRE-3159af1a-99
0.228

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O=C(NCc1ccc(CN2CCNC2=O)cc1)c1cncnc1

MAR-TRE-66ac689e-26
0.226

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COc1ccccc1OCCNC(=O)c1cc(N)nc2ccccc12

DAR-DIA-8e329c92-1
0.226

View
Cc1ncc(C(=O)NC2COCC2Cc2ccnc3ccccc23)c(=O)[nH]1

MAR-TRE-c8530538-13
0.226

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O=C1CC(Oc2cc(Cl)cc(CC(=O)Nn3cnc4ccccc43)c2)N1

MAT-POS-3b92565d-12
0.226

View
O=C1CC(Oc2cc(Cl)cc(CC(=O)Nn3cnc4ccccc43)c2)N1

MAT-POS-c478e61b-1
0.226

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COc1cc(CNC(=O)c2cncnc2)c2ccccc2n1

MAR-TRE-4f781e27-83
0.225

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CC(=O)Nc1ccc(N2CC(C(=O)Nc3cccnc3)CC2=O)cc1

KEI-TRE-d5e2018a-15
0.225

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CC(=O)Nc1ccc(N2C[C@@H](C(=O)Nc3cccnc3)CC2=O)cc1

MAR-TRE-7f7bb9f0-18
0.225

View
O=c1c2ncccc2n(Cc2cccc3ccccc23)c(=O)n1Cc1ccncc1

MAR-TRE-b77b7921-50
0.225

View
O=c1oc(Nc2ccccc2)nc2ccccc12

LON-WEI-4d77710c-72
0.224

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O=c1oc(Nc2ccccc2)nc2ccccc12

MAT-POS-ea426761-13
0.224

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NC(=O)C1CCN(Cc2nc(O)c3ccccc3n2)CC1

MAR-TRE-f5c2d31c-48
0.224

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Cn1ncc2c(=O)[nH]c(CCC(=O)Nc3cccnc3)nc21

MAR-TRE-2fd8122f-80
0.224

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Cn1ncc2c(=O)[nH]c(CN3CCCC(C(=O)c4ccccn4)C3)nc21

MAR-TRE-c8530538-95
0.224

View
O=C(Nn1cnc2ccccc2c1=O)C1COc2ccc(Cl)cc2C1

KRI-MAR-d2e3ef86-19
0.223

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O=C(Nn1cnc2ccccc21)C(Cc1ccsc1)c1ccc(N2CCCCC2=O)cc1

ALP-POS-8ed8d9ec-14
0.223

View
O=C(NCc1cccc(COc2ccccc2)c1)Nn1cnc2ccccc21

BAR-COM-0f94fc3d-42
0.222

View
O=C(NCc1ccc(CN2C(=O)CNC2=O)cc1)c1cncnc1

MAR-TRE-66ac689e-20
0.222

View
O=C(Nc1nc2ccccc2n1Cc1cncnc1)NC1CCCCC1

MAK-UNK-f2409524-7
0.222

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c1ccc(CN2CCOC(COc3ccccc3CNc3nc4ccccc4[nH]3)C2)cc1

MAK-UNK-a7992eb3-19
0.221

View
O=C(Cn1c(=O)n(Cc2ccncc2)c(=O)c2ncccc21)Nc1ccccc1F

MAR-TRE-d0525fbf-47
0.221

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Cn1c([C@@H](NC(=O)Cc2ccncc2)c2ccccc2)nc2ccccc21

BAR-COM-655b106d-2
0.221

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COc1cc(OC)cc(N2CC(C(=O)Nc3cccnc3)CC2=O)c1

MAR-TRE-2fd8122f-42
0.221

View
O=c1[nH]c2cccnc2c(=O)n1Cc1ccncc1

MAR-TRE-9c797165-93
0.221

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CCc1ccc(C(=O)Cn2c(=O)n(Cc3ccncc3)c(=O)c3ncccc32)cc1

MAR-TRE-b77b7921-36
0.220

View
Cc1nc(C)c(CC(=O)NCCc2csc(-c3ccncc3)n2)c(=O)[nH]1

MAR-TRE-c8530538-11
0.220

View
COc1ccc(N2CC(C(=O)Nc3cccnc3)CC2=O)c(OC)c1

KEI-TRE-d5e2018a-49
0.220

View
O=C(NCc1ccc(CN2CCCC2=O)cc1)c1cncnc1

MAR-TRE-66ac689e-21
0.220

View
CN1CCCc2c(S(N)(=O)=O)ccc(CCNC(=O)c3cc(=O)[nH]c4ccccc34)c21

DAR-DIA-8e329c92-13
0.220

View
CSCc1nc2ccccc2n1CC(=O)NC1CCOC1c1ccncc1

BAR-COM-4e090d3a-33
0.220

View
Cc1ccccc1NC(=O)Cn1c(=O)n(Cc2ccncc2)c(=O)c2ncccc21

MAR-TRE-3e4e6814-32
0.220

View
O=C(Cc1cc(Cl)cc(OC2CC(=O)N2)c1)Nc1nc2ccccc2[nH]1

ALP-POS-a30bcdb4-1
0.220

View
O=C(NCc1ccncc1)Nc1cccc(CNC(=O)c2cncnc2)c1

MAR-TRE-799db12b-97
0.219

View
COCCOC(=O)c1cc2c(=O)[nH]c(=O)n(CCc3ccccc3)c2nc1C

MAT-POS-b5746674-134
0.218

View
O=C(Cn1c(=O)c2nncn2c2ncccc21)NCc1ccccc1

MAR-TRE-74c6519b-27
0.218

View
Cc1ccncc1CC(=O)NCc1ccc2c(c1)CN(C(=O)C(C)(C)F)C2

BAR-COM-0f94fc3d-11
0.218

View
O=C(Cn1c(=O)n(Cc2ccncc2)c(=O)c2ncccc21)Nc1ccccc1

MAR-TRE-4b834d9a-81
0.218

View
O=C(NC[C@H]1CCCO1)/C(=C/c1cn(-c2ccccc2)nc1-c1cc2ccccc2oc1=O)NC(=O)c1ccccc1

BRU-UNI-248b30bc-18
0.218

View
COc1ccc2ccccc2c1CNC(=O)c1cncnc1

MAR-TRE-92684b97-96
0.218

View
NC(=O)CSc1nc(SCC(N)=O)c2ccccc2n1

MAR-TRE-f5c2d31c-30
0.218

View
CCc1ccccc1NC(=O)Cn1c(=O)n(Cc2ccncc2)c(=O)c2ncccc21

MAR-TRE-74c6519b-32
0.218

View
N#Cc1nc2ccccc2n1CC(=O)NCc1ccc2c(c1)CCC(=O)N2

MAR-TRE-fd17a9b8-51
0.218

View
O=C(NCc1cccs1)C1CCN(CCc2c[nH]c3ncccc23)CC1

MAR-TRE-3159af1a-75
0.218

View
O=C(NCc1cc(F)cc(F)c1)C1CCN(CCc2c[nH]c3ncccc23)CC1

MAR-TRE-3159af1a-1
0.218

View
O=C(NCc1cccnc1)C1CCN(Cc2ccc3c(c2)OCO3)CC1

MAR-TRE-fd17a9b8-44
0.217

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(Cc2ccccc2)C1

0.868

View
Cc1ccc(CN2CC(C(=O)NCc3nc4ccccc4c(=O)[nH]3)CC2=O)cc1

0.807

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(Cc2ccccn2)C1

0.772

View
COc1ccc(CN2CC(C(=O)NCc3nc4ccccc4c(=O)[nH]3)CC2=O)cc1

0.767

View
CCN1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.732

View
CCCN1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.707

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(Cc2ccco2)C1

0.705

View
O=C(NCc1ccncc1)C1CC(=O)N(Cc2ccccc2)C1

0.704

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1

0.703

View
O=C(NCc1nc2ccccc2[nH]1)C1CC(=O)N(Cc2ccccc2)C1

0.702

View
CN(C)CCN1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.700

View
COCCN1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.700

View
O=C(NCc1nc2cccnc2[nH]1)C1CC(=O)N(Cc2ccccc2)C1

0.695

View
CC(C)CN1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.695

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(CC(F)(F)F)C1

0.695

View
CN1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.679

View
Cc1ccc(CN2CC(C(=O)NCc3nc4ccccc4[nH]3)CC2=O)cc1

0.656

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(C2CC2)C1

0.644

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(CCN2CCOCC2)C1

0.641

View
Cc1ccc(CN2CC(C(=O)NCc3nc4cccnc4[nH]3)CC2=O)cc1

0.635

View
O=C(NCc1nnc(-c2ccncc2)[nH]1)C1CC(=O)N(Cc2ccccc2)C1

0.635

View
CC(C)(C)N1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.633

View
Cc1nc(CNC(=O)C2CC(=O)N(Cc3ccccc3)C2)nc2ccccc12

0.629

View
O=C(NCc1n[nH]c(=O)[nH]1)C1CC(=O)N(Cc2ccccc2)C1

0.627

View
CCN1CCCC1CN1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.627

View
COc1ccc(CN2CC(C(=O)NCc3nc4ccccc4[nH]3)CC2=O)cc1

0.625

View
O=C(NCc1nc2ccccc2[nH]1)C1CC(=O)N(Cc2ccccn2)C1

0.623

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(c2ccccc2Br)C1

0.623

View
Cc1nc(CNC(=O)C2CC(=O)N(Cc3ccccc3)C2)[nH]c1C

0.623

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(C2CCCC2)C1

0.623

View
O=C(OCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(Cc2ccccc2)C1

0.623

View
Cc1ccc(CN2CC(C(=O)NCc3ccncc3)CC2=O)cc1

0.621

View
O=C(NCc1ccncc1)C1CC(=O)N(Cc2ccccn2)C1

0.621

View
O=C(NCCc1ccncc1)C1CC(=O)N(Cc2ccccc2)C1

0.621

View
O=C1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)C1

0.618

View
O=C(NCc1ncccn1)C1CC(=O)N(Cc2ccccc2)C1

0.614

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(c2cccc3ccccc23)C1

0.613

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(c2ccccc2F)C1

0.613

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(c2ccccc2Cl)C1

0.613

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(C2CCCCC2)C1

0.613

View
CCC(CC)N1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.613

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC1

0.611

View
O=C(NCc1nc2cc(F)ccc2[nH]1)C1CC(=O)N(Cc2ccccc2)C1

0.609

View
CCc1ccc(N2CC(C(=O)NCc3nc4ccccc4c(=O)[nH]3)CC2=O)cc1

0.609

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CCCCN1Cc1ccncc1

0.609

View
Cc1ccc(CN2CC(C(=O)NCc3nc(C)c4ccccc4n3)CC2=O)cc1

0.609

View
O=C(NCc1ccnc2ccccc12)C1CC(=O)N(Cc2ccccc2)C1

0.607

View
COc1ccc(CN2CC(C(=O)NCc3nc4cccnc4[nH]3)CC2=O)cc1

0.606

View
O=C(NCc1nc2cccnc2[nH]1)C1CC(=O)N(Cc2ccccn2)C1

0.603

View
CC(C1CC1)N1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.603

View
Cc1cc(=O)[nH]c(CNC(=O)C2CC(=O)N(Cc3ccccc3)C2)n1

0.603

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(c2ccc(Cl)cc2)C1

0.603

View
CC1CCC(N2CC(C(=O)NCc3nc4ccccc4c(=O)[nH]3)CC2=O)CC1

0.603

View
O=C(NCc1ncc[nH]1)C1CC(=O)N(Cc2ccccc2)C1

0.600

View
O=C(NCc1nc2cc(Cl)ccc2[nH]1)C1CC(=O)N(Cc2ccccc2)C1

0.600

View
O=C(NCc1ccncc1)C1CC(=O)N(Cc2ccccc2Cl)C1

0.600

View
Cc1ccc2[nH]c(CNC(=O)C3CC(=O)N(Cc4ccccc4)C3)nc2c1

0.600

View
CN1CCC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.600

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CCN(Cc2ccccc2)C1

0.597

View
O=C(NCCc1nc2ccccc2[nH]1)C1CC(=O)N(Cc2ccccc2)C1

0.597

View
O=C(NCc1nc(-c2ccccc2)n[nH]1)C1CC(=O)N(Cc2ccccc2)C1

0.597

View
O=C(NNc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(Cc2ccccc2)C1

0.597

View
CCN1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CCC1=O

0.597

View
CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CC(=O)N(Cc2ccccc2)C1

0.594

View
CC(c1ccccc1)N1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.594

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1

0.594

View
O=C(NCc1nc(-c2ccccn2)n[nH]1)C1CC(=O)N(Cc2ccccc2)C1

0.594

View
O=C(NCc1nc2c([nH]1)CCCC2)C1CC(=O)N(Cc2ccccc2)C1

0.594

View
CCc1ccccc1N1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.594

View
CCN1CC(C(=O)NCc2nc3ccccc3[nH]2)CC1=O

0.593

View
O=C(NCc1cccnc1)C1CC(=O)N(Cc2ccccc2)C1

0.593

View
O=C(NCc1ccccc1)C1CC(=O)N(Cc2ccccc2)C1

0.593

View
O=C(NCc1nc(-c2ccncc2)no1)C1CC(=O)N(Cc2ccccc2)C1

0.591

View
CCCc1ccc(N2CC(C(=O)NCc3nc4ccccc4c(=O)[nH]3)CC2=O)cc1

0.591

View
COc1ccc(CN2CC(C(=O)NCc3ccncc3)CC2=O)cc1

0.590

View
O=C(NCc1ccncc1)C1CC(=O)N(Cc2ccccc2F)C1

0.590

View
O=C(NCCCc1ccncc1)C1CC(=O)N(Cc2ccccc2)C1

0.590

View
O=C(NCc1nc(=O)o[nH]1)C1CC(=O)N(Cc2ccccc2)C1

0.590

View
O=C(NCc1ccncn1)C1CC(=O)N(Cc2ccccc2)C1

0.590

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CCN(Cc2ccccc2)CC1

0.590

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CCCC1

0.589

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CCC1

0.589

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC=CC1

0.589

View
O=c1[nH]c(CNC(=O)[C@H]2C[C@@H](O)C2)nc2ccccc12

0.589

View
O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC(=O)N(Cc2ccccc2)C1

0.588

View
O=C(NCc1nc2ccccc2[nH]1)C1CC(=O)N(Cc2ccccc2Cl)C1

0.587

View
O=C(NCc1ccccc1-c1ccncc1)C1CC(=O)N(Cc2ccccc2)C1

0.587

View
O=C1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CN1

0.586

View
O=C(NCc1ccncc1)Nc1cccc(CNC(=O)C2CC(=O)N(Cc3ccccc3)C2)c1

0.585

View
O=C(NCc1nc2cccnc2[nH]1)C1CC(=O)N(Cc2ccccc2Cl)C1

0.585

View
COc1ccccc1N1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.585

View
CCCC(C)N1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.585

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(c2cn[nH]c2)C1

0.585

View
Cc1ccc(CN2CC(C(=O)NCc3nc4cc(C)ccc4[nH]3)CC2=O)cc1

0.585

View
Cc1cccc(N2CC(C(=O)NCc3nc4ccccc4c(=O)[nH]3)CC2=O)c1C

0.585

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(c2cccc(Br)c2)C1

0.585

View
Cc1ccc(CN2CC(C(=O)OCc3nc4ccccc4c(=O)[nH]3)CC2=O)cc1

0.585

View
CN1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CCC1=O

0.583

View
Cc1n[nH]c(CNC(=O)C2CC(=O)N(Cc3ccccc3)C2)n1

0.581

View
O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CCN(c2ncccn2)CC1

0.581

View
COCCN1CC(C(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)CC1=O

0.185

View
CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CNCC12CC2

0.182

View
CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CC(=O)N(CC(F)(F)F)C1

0.178

View
CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CC(=O)N(Cc2ccco2)C1

0.174

View
CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)CCN1C(=O)CCC1=O

0.173

View
CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CC(=O)N(C2CCCC2)C1

0.159

View
CN1C[C@H]2CNC[C@@]2(C(=O)NCc2nc3ccccc3c(=O)[nH]2)C1

0.156

View
CC(=O)N1CCC(C)(C(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)C1

0.142

View
CC(=O)N1CCC(C(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)C1

0.142

View
CC(C)N(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CC(=O)N(C2CC2)C1

0.140

View
CN1CC(C(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)CC1=O

0.135

View
CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CC(=O)N(C2CC2)C1

0.133

View
CCN1CC(C(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)CC1=O

0.130

View
CC(C)N1CC(C(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)CC1=O

0.129

View
CC(C)CN1CC(C(=O)NCc2nc3ccccc3c(=O)[nH]2)CC1=O

0.126

View
CC(C)N(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CC(=O)N(Cc2ccccc2)C1

0.093

View
C(NCC1=NC2=C(C=CC=C2)N1)(=O)C1CN(CC2=CC=CC=C2)C(=O)C1

0.741

View
C(NCC1=NC2=C(C=CC=C2)N1)(=O)C1CN(CC2=CC=C(F)C=C2)C(=O)C1

0.733

View
C(NCC1=NC2=C(C=CC=C2)N1)(=O)C1CN(CC2=CC=CC(F)=C2)C(=O)C1

0.730

View
C(NCC1=NC2=C(C=CC=C2)N1)(=O)C1CC(=O)N(CC2=CC=C(C)C=C2)C1

0.724

View
C(NCC1=NC2=C(C=NC=C2)N1)(=O)C1CN(CC2=CC=CC=C2)C(=O)C1

0.721

View


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