Molecule Details

Molecular Properties
SMILES:
O=C(NCCc1ccncc1)c1ccccc1F
MW: 244.269
Fraction sp3: 0.14
HBA: 2
HBD: 1
Rotatable Bonds: 4
TPSA: 41.99
cLogP: 2.1932
Covalent Warhead:
Covalent Fragment:
Source
Enamine SCR: Z606937774
Enamine REAL: Z1310876699
Enamine Extended REAL: s_22____1155120____58903
Mcule: MCULE-2684784593
Mcule Ultimate: HQJMILNSKHZGJL-UHFFFAOYSA-N
MolPort: MolPort-002-096-659
O=S(=O)(NCCc1ccncc1)c1ccccc1F

IND-SYN-8bc6954a-2
0.468

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CC(=O)Nc1cncc(CCNC(=O)c2ccccc2F)c1C

DOU-UNK-b5326f8f-2
0.465

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CN(Cc1cc(CCNC(=O)c2ccccc2F)ccn1)C(=O)NC1CC1

ASH-UNK-40b46b30-4
0.457

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Cc1ccncc1NC(=O)CCNC(=O)c1ccccc1F

PET-SGC-2e937068-1
0.451

View
COCCn1cc(CCNC(=O)c2ccccc2F)c2cccnc21

MAR-TRE-3159af1a-68
0.398

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O=C(NCCc1ccncc1)NC1CCCCC1

AAR-POS-d2a4d1df-12
0.373

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

MAR-TRE-c8530538-90
0.342

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COc1cc(CCNC(=O)c2cncnc2)ccc1F

MAR-TRE-8190bb11-95
0.329

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O=C(NC(CCc1ccncc1)C(=O)O)c1cncnc1

MAR-TRE-4f781e27-39
0.324

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CC(=O)NCCc1ccccc1

ANT-DIA-b7f58f21-4
0.310

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O=C(Nc1ccccc1)NC12CC(CCNC(=O)c3ccccc3F)CCN1C2

SAD-SAT-cefd50cc-5
0.304

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O=C(CCl)Nc1nc2c(C(=O)NCCc3cccc(F)c3)cccc2s1

WAL-WAB-df110a02-1
0.302

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O=C(Cc1csc(NC(=O)c2ccccc2F)n1)Nc1cccnc1

MAR-TRE-2fd8122f-53
0.299

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O=C(SCF)C1CCN(C(=O)c2ccccc2F)CC1

GIA-UNK-995df016-14
0.284

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O=C(COc1ccccc1)NCCc1ccccc1

ALE-UNK-fca05062-4
0.284

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

MAR-TRE-e82e6c98-54
0.274

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CC(=O)NCCNC(=O)c1ccccc1NC(=O)c1cncnc1

MAR-TRE-799db12b-20
0.269

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Fc1ccccc1-c1nc(Cc2ccncc2)co1

IND-SYN-8bc6954a-1
0.267

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CSc1ncccc1C(=O)NCCc1nc(C)cc(=O)[nH]1

MAR-TRE-c8530538-39
0.259

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O=C(NCCNc1cccnn1)c1ccccc1NS(=O)(=O)c1cc(F)ccc1F

BAR-COM-4e090d3a-10
0.258

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O=C(NCCc1ccccc1)c1ccc2c(c1)CCCN2C(=O)c1ccc(F)cc1

MAT-POS-b5746674-112
0.258

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Cc1cccc(C)c1OCC(=O)NCCc1ccccc1

ALE-UNK-fca05062-3
0.257

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CN(C)C(=O)NCCc1ccc(NC(=O)c2cncnc2)cc1

MAR-TRE-8190bb11-69
0.256

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Cc1cc(=O)[nH]c(CCNC(=O)c2cccnc2O)n1

MAR-TRE-c8530538-45
0.256

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

MAR-TRE-d0525fbf-47
0.255

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O=C(Nc1cccnc1)Nc1ccccc1C(=O)NCCc1c[nH]c2ccc(F)cc12

MAK-UNK-37f1d6fa-1
0.255

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O=C(NC1CCCCC1NC(=O)c1ccncc1)c1ccccc1

GIA-UNK-d2defdc3-2
0.254

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N=C(N)NCCc1ccc(NC(=O)Nc2cccnc2)cc1

WIL-UNI-5578df48-14
0.253

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Cc1ccncc1NC(=O)CCc1ccccc1F

BEN-DND-93268d01-7
0.253

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O=C(Nc1ccccc1C(=O)NCc1cccnc1)c1cncnc1

MAR-TRE-4f781e27-34
0.253

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COC(=O)CCCC(=O)N1CCN(c2ccc(NC(=O)c3ccccc3F)cn2)CC1

MAR-TRE-74c6519b-96
0.253

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O=C(NC(CCc1ccc(F)cc1)C(=O)O)c1cncnc1

MAR-TRE-92684b97-41
0.250

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CN(Cc1ccccc1)C(=O)Cn1nnc(-c2ccccc2NC(=O)c2ccccc2F)n1

MAR-LAB-ff9967db-33
0.250

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CC(=O)Nc1ccc(-n2cnc(C(=O)NCCc3ccccc3)c2)nc1

MAR-TRE-74c6519b-100
0.250

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

MAR-TRE-c8530538-97
0.250

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

GIA-UNK-3f36037a-7
0.250

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O=C(NCCCN1C(=O)c2ccccc2C1=O)c1cncnc1

MAR-TRE-8190bb11-96
0.250

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O=C(Nc1ccccc1)Nc1cnccc1C(=O)NCCc1c[nH]c2ccc(F)cc12

MAK-UNK-37f1d6fa-4
0.248

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CNc1ncccc1C(=O)NCCc1nc(C)cc(=O)[nH]1

MAR-TRE-c8530538-53
0.247

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C=CC(=O)NCCc1ccc(S(N)(=O)=O)cc1

SAD-SAT-1f400d17-7
0.246

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N#CCNC(=O)c1ccccc1S(N)(=O)=O

WIL-NOV-649f4ed0-4
0.246

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O=C(NCCNc1ccncc1)c1cccc(S(=O)(=O)Nc2ccccc2-c2ccccc2)c1

ERI-BAS-962ecb40-1
0.245

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C#CCNC(=O)c1ccccc1NC(=O)c1cncnc1

MAR-TRE-8190bb11-51
0.244

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O=C(NC(c1ccncc1)c1ccc(F)cc1)c1cncnc1

MAR-TRE-66ac689e-58
0.243

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

MAR-TRE-799db12b-97
0.241

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O=C(Cc1ccc(F)cc1)NCCNC(=O)c1cncnc1

MAR-TRE-4f781e27-85
0.240

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O=C(CCl)CNc1cncc(CCNC(=O)c2cccc(Cl)c2)c1

NIM-UNI-6eebfcd4-2
0.239

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Cc1ccc(CNC(=O)c2ccccc2NC(=O)c2cncnc2)cc1

MAR-TRE-9d18ae8c-83
0.238

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COc1cc(Br)cc(CCNC(=O)c2cncnc2)c1

MAR-TRE-4f781e27-16
0.237

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O=C(NCc1nc2ccccc2c(=O)[nH]1)C1CC(=O)N(Cc2ccncc2)C1

MAR-TRE-c8530538-4
0.235

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O=C(Nc1ccccc1C(=O)NCc1ccc2c(c1)OCO2)c1cncnc1

MAR-TRE-92684b97-22
0.234

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Cn1c([C@@H](NC(=O)Cc2ccncc2)c2ccc(Cl)cc2)nc2ccccc21

BAR-COM-655b106d-4
0.233

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O=C(NCCc1c[nH]c2c(C(=O)O)cccc12)c1cncnc1

MAR-TRE-4f781e27-23
0.233

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CCC(C(=O)Nc1cccnc1)N(c1ccccc1F)S(C)(=O)=O

KEI-TRE-d5e2018a-43
0.233

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COCCn1cc(CCNC(=O)c2ccncc2)c2cccnc21

MAR-TRE-3159af1a-27
0.231

View
CC(NCCc1cccc(CC(=O)N2C=CN(C)C=C2)c1)c1ccccc1F

JOR-WAB-5f511e4e-1
0.231

View
Cc1ccncc1NC(=O)CCc1ccc(F)cc1

BEN-DND-93268d01-5
0.231

View
Cn1cc(NC(=O)NCCc2ccc(Cl)cc2)c2ccccc2c1=O

MAT-POS-2492181e-1
0.230

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O=C(NCCc1c[nH]c2cc(F)c(Cl)cc12)c1cncnc1

MAR-TRE-e82e6c98-51
0.230

View
CCc1cnc2[nH]cc(CCNC(=O)c3ccccc3)c2c1

ROM-UNK-ef52a3c9-4
0.230

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

BAR-COM-655b106d-2
0.230

View
O=C(CCl)N1CCN(S(=O)(=O)c2c(F)cccc2F)c2ccncc21

JOE-SYG-2c9a1216-2
0.230

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CC(=O)NCCc1cccc(CC(=O)NCc2cccnc2)c1

CHA-MCP-85291e1d-7
0.229

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CC(=O)NCCc1cccc(CC(=O)Nc2cccnc2)c1

CHA-MCP-85291e1d-1
0.229

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Cc1ncc(C(=O)NCCNc2ccncc2C)c(=O)[nH]1

MAR-TRE-c8530538-43
0.229

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

BEN-DND-7e92b6ca-4
0.229

View
O=C(NC(c1cccnc1)c1ccc(F)c(F)c1)c1cncnc1

MAR-TRE-4f781e27-68
0.229

View
O=C(CCl)N1CCN(c2c(F)cc(-c3ccncc3)cc2F)CC1

NIM-UNI-310206f0-1
0.228

View
O=C(NCCc1cccc2ccccc12)c1cc(=O)[nH]c2ccccc12

DAR-DIA-8e329c92-9
0.227

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccccc2F)CC1

AAR-POS-d2a4d1df-34
0.227

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccccc2F)CC1

MAR-TRE-6a44bbf2-8
0.227

View
COc1ccccc1OCCNC(=O)c1cc(=O)[nH]c2cccc(F)c12

EDJ-MED-6af13d92-2
0.226

View
O=C(Cn1c(=O)n(Cc2ccccc2)c(=O)c2ncccc21)NCCc1ccccc1

MAR-TRE-f6f5f473-7
0.226

View
O=C(Cc1cccnc1)NCc1ccccc1

NAU-LAT-64f4b287-9
0.225

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O=C(NCc1cccc(NC(=O)c2cccc(F)c2)c1)c1cncnc1

MAR-TRE-9d18ae8c-10
0.225

View
O=C(CCl)NCCc1cnn(-c2ccccc2)c1

MAR-TRE-6a44bbf2-44
0.224

View
O=C(NC(CCc1ccccc1)c1ccccn1)c1cncnc1

MAR-TRE-9d18ae8c-50
0.224

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O=C(NC(c1cccc(F)c1)c1ccccn1)c1cncnc1

MAR-TRE-92684b97-18
0.224

View
O=C(NCc1cccc(NC(=O)c2ccncc2)c1)c1cncnc1

MAR-TRE-799db12b-2
0.224

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O=C(Nc1ccccc1C(=O)NCc1ccco1)c1cncnc1

MAR-TRE-799db12b-60
0.224

View
O=C(NCCc1ccccc1)C(c1cccnc1)N(C(=O)CCl)c1ccccc1Cl

JAN-GHE-76def03c-2
0.223

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O=C(Cn1c(=O)n(-c2ccc(F)cc2)c2ncccc21)NCc1ccncc1

MAR-TRE-67513f76-11
0.223

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CNCc1cc(-c2ccccc2F)n(C(C(=O)NC)c2cccnc2)c1

MAK-UNK-0955449e-3
0.223

View
O=C(NCc1ccno1)c1ccccc1Oc1ccc(Cl)cc1Cl

BAR-COM-4e090d3a-42
0.222

View
O=C(NC(c1ccc(F)cc1)c1ccccn1)c1cncnc1

MAR-TRE-92684b97-15
0.222

View
CC(O)(CNC(=O)c1c[nH]c2ncccc12)C(=O)O

MAR-TRE-3159af1a-58
0.222

View
O=C(c1ccccc1)N(C1CCC(O)CC1)S(=O)(=O)c1ccccc1F

WAR-XCH-bdd24732-40
0.222

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CC(NC(=O)c1cncnc1)c1cccc(NC(=O)Cc2ccccc2F)c1

MAR-TRE-9d18ae8c-62
0.221

View
Cc1nn(C)cc1-c1c(-c2ccccc2)ncn1CCNC(=O)c1ccncc1

MAT-POS-ea426761-86
0.221

View
O=C(NC(c1ccc(Cl)c(F)c1)c1nnn[nH]1)c1cncnc1

MAR-TRE-799db12b-58
0.221

View
O=C(NCCc1nc2cc(F)ccc2[nH]1)c1cncnc1

MAR-TRE-be9ff7d2-37
0.221

View
O=C(NCc1ccnn1CCc1ccccc1)c1cncnc1

MAR-TRE-4f781e27-48
0.221

View
O=C(NCCC(c1ccccc1)c1ccccc1)c1cnccn1

AUS-ARG-7cfdce8f-13
0.221

View
O=C(CCl)Nc1ccccc1S(=O)(=O)NC(=O)c1cncnc1

MAR-TRE-66ac689e-50
0.220

View
O=C(NC1(C(=O)O)CCN(Cc2ccccc2)CC1)c1cncnc1

MAR-TRE-66ac689e-83
0.220

View
O=C(Cc1ccc(F)cc1)Nc1cccnc1

MAK-UNK-a7b37c5e-5
0.219

View
N#Cc1cnc(SCC(=O)NCCc2ccccc2)nc1N

MAR-TRE-0fda4e82-1
0.218

View
COc1ccc(CCNC(=O)CN(Cc2ccccc2)S(=O)(=O)c2ccccc2)cc1

MAT-POS-b5746674-58
0.218

View
O=C(NCCc1c[nH]c2c(F)cc(Cl)cc12)c1cncnc1

MAR-TRE-be9ff7d2-39
0.218

View
O=C(Nc1cccnc1)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1

MAR-TRE-2fd8122f-65
0.218

View
O=C(NCCC1=CC=NC=C1)C1=CC=CC=C1F

1.000

View
O=C(NCCNC(=O)C1=CC=CC=C1F)NCCC1=CC=NC=C1

0.782

View
O=C(NCCNC(=O)C1=CC=CC=C1F)C(=O)NCCC1=CC=NC=C1

0.782

View
O=C(NCCCNC(=O)C1=CC=CC=C1F)C(=O)NCCC1=CC=NC=C1

0.729

View
O=C(NCCC1=CC=NC=C1)NNC(=O)C1=CC=CC=C1F

0.702

View
O=C(NCCC1=CC=C(F)C=C1)C1=CC=CC=C1F

0.692

View
O=C(NCCC1=CC=C(O)C=C1)C1=CC=CC=C1F

0.667

View
O=C(NCCC1=CC=C(Cl)C=C1)C1=CC=CC=C1F

0.667

View
O=C(NCCC1=CC=NC=C1)C1=CC=CC=C1Cl

0.667

View
O=C(NCCC1=CC=C(CO)C=C1)C1=CC=CC=C1F

0.667

View
O=C(NCCC1=CC=C(C(F)(F)F)C=C1)C1=CC=CC=C1F

0.661

View
O=C(NCCC1=CC=NC=C1)C1=CC=CC=C1O

0.660

View
O=C(NCCC1=CC=NC=C1)C1=C(F)C(F)=CC=C1

0.655

View
O=C(NCCC1=CC=NC=C1)C1=CC=NC=C1F

0.655

View
O=C(NCCC1=CC=NC=C1)C1=CC=C(F)C=C1F

0.655

View
O=C(NCCC1=CC=C(Br)C=C1)C1=CC=CC=C1F

0.655

View
CC1=CC=C(CCNC(=O)C2=CC=CC=C2F)C=C1

0.655

View
CCC1=CC=C(CCNC(=O)C2=CC=CC=C2F)C=C1

0.655

View
NC1=CC=C(CCNC(=O)C2=CC=CC=C2F)C=C1

0.655

View
CC1=CC=CC(C(=O)NCCC2=CC=NC=C2)=C1NC(=O)C1=CC=CC=C1F

0.652

View
O=C(CCC1=CC=NC=C1)NCCNC(=O)C1=CC=CC=C1F

0.650

View
O=C(NCCC1=CC=CN=C1)C1=CC=CC=C1F

0.649

View
O=C(NCC1=CC=NC=C1)C1=CC=CC=C1F

0.648

View
O=C(CC1=CC=NC=C1)NCCNC(=O)C1=CC=CC=C1F

0.638

View
CC1=CC=CC=C1C(=O)NCCC1=CC=NC=C1

0.636

View
O=C(NCCC1=CC=NC=C1)C1=CC=C(Cl)C=C1F

0.632

View
O=C(NCCCC1=CC=NC=C1)NCCNC(=O)C1=CC=CC=C1F

0.629

View
CC(=O)C1=CC=CC=C1C(=O)NCCC1=CC=NC=C1

0.625

View
O=C(NCCC1=CC=NC=C1)C1=CC=CC=C1Br

0.625

View
O=C(NCCC1=CC=NC=C1)C1=CC=CC=C1I

0.625

View
O=C(NCCC1=CC=NC=C1)C1=CC=C(Br)C=C1F

0.621

View
CC1=CC=C(C(=O)NCCC2=CC=NC=C2)C(F)=C1

0.621

View
O=C(NCCN1CCN(C(=O)NCCC2=CC=NC=C2)CC1)C1=CC=CC=C1F

0.614

View
CCC1=CC=CC=C1C(=O)NCCC1=CC=NC=C1

0.614

View
O=C(NCCC1=CC=NC=C1)C1=CC=C(C2=CC=CC=C2)C=C1F

0.613

View
O=C(NCCC1=CC=NC=C1)C1=C(Br)C(F)=CC=C1

0.610

View
O=C(NCCC1=CC=NC=C1)C1=C(Cl)C(F)=CC=C1

0.610

View
NC1=C(F)C=CC=C1C(=O)NCCC1=CC=NC=C1

0.610

View
O=C(NCCC1=CC=NC=C1)C1=C(I)C(F)=CC=C1

0.610

View
O=C(NCCC1=CC=NC=C1)C1=CC=CC=C1C(F)(F)F

0.610

View
CC(=O)C1=CC=C(C(=O)NCCC2=CC=NC=C2)C(F)=C1

0.610

View
O=C(NCCN1CCN(CCC2=CC=NC=C2)CC1)C1=CC=CC=C1F

0.609

View
CN(CCC1=CC=NC=C1)C(=O)NCCNC(=O)C1=CC=CC=C1F

0.609

View
O=C(NCCC1=CC(F)=CC(F)=C1)C1=CC=CC=C1F

0.607

View
O=C(NCCNC(=O)C1=CC=CC=C1F)NCC1=CC=NC=C1

0.607

View
O=C(NCCC1=CC=NC=C1)C1=CC=CN=C1F

0.603

View
CNC1=CC=CC=C1C(=O)NCCC1=CC=NC=C1

0.603

View
O=C(NCCC1=CC=NC=C1)C1=C(F)C=CC=C1F

0.600

View
CSC1=C(F)C=CC=C1C(=O)NCCC1=CC=NC=C1

0.600

View
O=C(NCCNC(=O)C1=CC=CC=C1F)C(=O)NCC1=CC=NC=C1

0.597

View
O=C(NCCNC(=O)C1=CC=CC=C1F)C1=CC=NC=C1

0.596

View
O=C(NCCC1=CC=NC=C1)C1=C(F)C=C(F)C(F)=C1

0.596

View
O=C(NCCC1=CC=NC=C1)C1=CC(F)=CC=C1F

0.593

View
O=C(NCCC1=CC=NC=C1)C1=CC(Cl)=CC=C1F

0.593

View
CC(C)C1=CC=CC=C1C(=O)NCCC1=CC=NC=C1

0.593

View
O=C(NCCC1=CC=NC=C1)C(=O)N1CCN(CCNC(=O)C2=CC=CC=C2F)CC1

0.589

View
O=C(NCCC1=CC=C(F)C(F)=C1)C1=CC=CC=C1F

0.586

View
O=C(NCCC1=CC(Cl)=CC(Cl)=C1)C1=CC=CC=C1F

0.586

View
CC1=CC=C(C(=O)NCCC2=CC=NC=C2)C=C1NC(=O)C1=CC=CC=C1F

0.586

View
O=C(NCCC1=CC=NC=C1)C1=CC=CC(Cl)=C1F

0.583

View
CC1=CC=CC(C(=O)NCCC2=CC=NC=C2)=C1F

0.583

View
O=C(NCCNC(=O)C1=CC=CC=C1F)C1=CC=CC=C1F

0.583

View
N#CC1=C(C(=O)NCCC2=CC=NC=C2)C=CC=C1F

0.581

View
O=C(NCCC1=CC=NC=C1)C1=CC=C(F)C(F)=C1F

0.576

View
O=C(NCCC1=CC=NC=C1)C1=C(F)C(F)=C(F)C(F)=C1

0.576

View
O=C(NCCC1=CC=NC=C1)C1=CC=CC(Br)=C1F

0.574

View
O=C(NCCC1=CC=NC=C1)C1=CC(Br)=CC=C1F

0.574

View
O=C(NCCC1=CC=NC=C1)C1=CC(I)=CC=C1F

0.574

View
CC1=CC=C(F)C(C(=O)NCCC2=CC=NC=C2)=C1

0.574

View
O=C(NCCN1CCN(CCCC2=CC=NC=C2)CC1)C1=CC=CC=C1F

0.574

View
O=C(NCCC1=CC=NC=C1)C1=CC=C(F)C2=CC=CC=C12

0.571

View
O=C(NCCC1=CC=NC=C1)C1=CC=C(C2=CC=C(F)C=C2)C=C1F

0.571

View
O=C(NCCC1=CC=NC=C1)C1=C[NH]C=C1C1=CC=CC=C1F

0.569

View
O=C(NCCC1=CC=NC=C1)C1=CC=CC=C1C(=O)C1=CC=C(F)C=C1

0.569

View
O=C(NCCCNC(=O)C1=CC=CC=C1F)C(=O)NCC1=CC=NC=C1

0.569

View
O=C(CC1=CC=NC=C1)NNC(=O)NCCNC(=O)C1=CC=CC=C1F

0.569

View
O=C(NCCC1=CC=NC=C1)C1=CC=CC=C1C(=O)C1=CC=C(F)C(F)=C1

0.567

View
CN(CCC1=CC=NC=C1)C(=O)C(=O)NCCNC(=O)C1=CC=CC=C1F

0.565

View
O=C(NCCC1=CC=NC=C1)C1=CC=CC2=CC=CC=C12

0.565

View
O=C(NCCNC(=S)NCCC1=CC=CC=C1)C1=CC=CC=C1F

0.565

View
O=C(NCCNC(=O)C1=CC=CC=C1F)NCCC1=CC=C(F)C=C1

0.565

View
O=C(NCCC1=CC=NC=C1)C1=CC=CC=C1C(=O)C1=CC=CC=C1

0.556

View
O=C(NCCC1=CC=NC=C1)C1=CC=CC=C1C1=CC=CC=C1

0.556

View
CC1=CN=CC=C1CCNC(=O)C1=CC=CC=C1F

0.556

View
O=C(NCCC1=CC=NC=C1)C1=C(SC2=CC=CC=C2)C(F)=CC=C1

0.552

View
O=C(NCCN1CCN(CC2=CC=NC=C2)CC1)C1=CC=CC=C1F

0.552

View
O=C(NCCC1=CC=NC=C1)C1=C[NH]N=C1C1=CC=CC=C1F

0.552

View
O=C(NCCNC(=O)C1=CC=NC=C1F)C1=CC=CC=C1F

0.552

View
O=C(NCCNC(=O)C1=CC=CC=C1F)C(=O)NCCC1=CC=C(F)C=C1

0.548

View
O=C(NCCNC(=O)C1=CC=CC=C1OCC1=CC=NC=C1)C1=CC=CC=C1F

0.544

View
O=C(NCCC1=CC=NC=C1)C1=CC=CN=C1NC1=CC=CC=C1F

0.543

View
O=C(NCCC1=CC=NC=C1)C1=C(C(=O)C2=CC=CC=C2)C=C(F)C(F)=C1

0.537

View
O=C(NCCNC(=O)C1=CC=CC=C1F)NCCC1=CC=CN=C1

0.537

View
O=C(NCCN1CCN(C(=O)CCC2=CC=NC=C2)CC1)C1=CC=CC=C1F

0.534

View
O=C(NCCC1=CC=NC=C1)C1=CC2=NC=CN=C2C=C1F

0.531

View
CC1=C(C(=O)NCCC2=CC=NC=C2)C=NN1C1=CC=CC=C1F

0.529

View
O=C(NCCNC(=O)C1=CC=CC=C1F)C(=O)NCCC1=CC=CN=C1

0.522

View
O=C(NCCNC(=O)N(CCC1=CC=CC=C1)CC1=CC=NC=C1)C1=CC=CC=C1F

0.520

View
O=C(NCCC1=CC=NC=C1)C1=C(N2C=CC=C2)N(C2=CC=CC=C2F)N=C1

0.493

View
O=C(NCCC1=CC=C(C2=CC=CC=C2)C=C1)C1=CC=NC=C1F

0.485

View
Fc1ccccc1C(=O)NCCc1ccncc1

1.000

View
Fc1ccccc1C(=O)NCCc1ccccc1

0.706

View
Fc1ccccc1C(=O)NCCc1cccnc1

0.649

View
Fc1cccc(c1)C(=O)NCCc1ccncc1

0.533

View
Fc1ccc(cc1)C(=O)NCCc1ccncc1

0.517

View
Cc1ccc(cc1)C(=O)NCCc1ccncc1

0.467

View
C(NCCC1=CC=NC=C1)(=O)C1=C(F)C=CC=C1

1.000

View
C(NCCCC1=CC=NC=C1)(C1=C(F)C=CC=C1)=O

0.722

View
C(NCCC1=CC=NC=C1)(=O)C1=C(F)C=C(F)C=C1

0.655

View
C(NCCC1=CC=CN=C1)(=O)C1=C(F)C=CC=C1

0.649

View
C(NCCC1=CC=NC=C1)(=O)C1=C(F)C=C(Cl)C=C1

0.632

View
C(NCCC1=CC=NC=C1)(=O)C1=C(F)C=CC=C1F

0.600

View
C(NCCC1=CC=NC=C1)(=O)C1=C(F)C=CC(F)=C1

0.593

View
C(NCCC1=CC=NC=C1)(=O)C1=C(F)C=CC(Cl)=C1

0.593

View
C(NCCC1=CC=NC=C1)(=O)C1=C(F)C(Cl)=CC=C1

0.583

View
C(NCCC1=CC=NC=C1)(=O)C1=C(F)C=CC(Br)=C1

0.574

View
C(NCCC1=CC=NC=C1)(=O)C1=C(F)C=CC(C=O)=C1

0.565

View
C(NCCC1=CC=NC=C1)(=O)C1C(F)=C(C#N)C=CC=1

0.556

View
C(NCCC1=CC=NC=C1)(=O)C1=C(Cl)C=CC=C1F

0.550

View
C(NCCC1=CC=NC=C1)(=O)C1=C(I)C=CC=C1F

0.541

View
C(NCCC1=CC=NC=C1)(=O)C1=CC=CC=C1

0.536

View
C(NCCC1=CC=NC=C1)(=O)C1=CC=CC(F)=C1

0.533

View
C(NCCC1=CC=NC=C1)(=O)C1=CC=C(F)C=C1

0.517

View
C(N(C)CCC1=CC=NC=C1)(=O)C1=C(F)C=CC=C1

0.516

View
C(NCCC1=CC=NC=C1)(=O)C1=CC(F)=C(C)C=C1

0.492

View
N(CC1=C(F)C=CC=C1)CCC1=CC=NC=C1

0.426

View

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