Molecule Details

Molecular Properties
SMILES:
CNCc1c[nH]c2ccc(F)cc12
MW: 178.21
Fraction sp3: 0.2
HBA: 1
HBD: 2
Rotatable Bonds: 2
TPSA: 27.82
cLogP: 2.0264
Covalent Warhead:
Covalent Fragment:
Source
Enamine SCR: Z1416178360
Mcule: MCULE-9962013314
MolPort: MolPort-022-570-392
Activity Data
Average Inhibition @ 50 µM - Fluorescence: 32.73232
Average Inhibition @ 20 µM - RapidFire: 3.0851406346071
Average Inhibition @ 50 µM - RapidFire: 16.1370977193326
Relative Solubility @ 20 µM: 0.99
Relative Solubility @ 100 µM: 1.0
Order Status
Shipped: 2020-05-07
CNCc1c[nH]c2ccc(Cl)cc12

DAR-DIA-eace69ff-37
0.569

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

ABI-SAT-30e287c1-2
0.526

View
CC(=O)NCCc1c[nH]c2ccc(F)cc12

AAR-POS-d2a4d1df-2
0.508

View
O=C(O)CC(=O)NCCc1c[nH]c2ccc(F)cc12

MAK-UNK-be5ffcbc-8
0.484

View
CC(=O)OCCc1c[nH]c2ccc(F)cc12

SAN-PRS-3c4a6997-4
0.483

View
CC(C)[C@H](O)C(=O)NCCc1c[nH]c2ccc(F)cc12

NAU-LAT-81109c57-1
0.455

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NCCC(=O)NCCc1c[nH]c2ccc(F)cc12

NAU-LAT-81109c57-8
0.439

View
N#Cc1c[nH]c2ccc(F)cc12

ABI-SAT-30e287c1-1
0.415

View
O=C(O)C(Cc1c[nH]c2ccc(F)cc12)Nc1cncnc1

MAR-TRE-85681e92-60
0.403

View
Cn1ccn(C(Cc2c[nH]c3ccc(F)cc23)C(=O)O)c1=[Au+]Cl

MAR-TRE-4f39ef4a-26
0.400

View
O=C(CN1CCOCC1)NCCc1c[nH]c2ccc(F)cc12

MAK-UNK-be5ffcbc-7
0.400

View
O=C(CN1CCNCC1)NCCc1c[nH]c2ccc(F)cc12

MAK-UNK-be5ffcbc-1
0.397

View
CN1CCC[C@H]1C(=O)NCCc1c[nH]c2ccc(F)cc12

NAU-LAT-81109c57-4
0.395

View
O=C(NCCc1c[nH]c2ccc(F)cc12)[C@@H]1CCCN1

NAU-LAT-81109c57-2
0.392

View
CC(NC1COCC1O)C(=O)NCCc1c[nH]c2ccc(F)cc12

MAK-UNK-be5ffcbc-3
0.390

View
O=C(CNCc1c[nH]c2ccc(F)cc12)NCc1ccc(CN2CCN(C(=O)CCl)CC2)cc1

MAK-UNK-72b7ba6b-1
0.384

View
O=C(CNCc1c[nH]c2ccc(F)cc12)NCc1ccc(CN2CCN(C(=O)CCl)CC2)cc1

MAK-UNK-176ca439-5
0.384

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

MAR-TRE-7f7bb9f0-83
0.383

View
O=C(NCCc1c[nH]c2ccc(F)cc12)NCC1CCCCC1

FRA-LAB-04e32718-1
0.377

View
C=CC(=O)N1CCN(Cc2ccc(CNC(=O)CNCc3c[nH]c4ccc(F)cc34)cc2)CC1

MAK-UNK-10dfa458-15
0.375

View
CC(=O)NCc1c[nH]c2ccc(C#N)cc12

SCO-VAN-260d9628-5
0.369

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

MAK-UNK-37f1d6fa-2
0.345

View
COc1cncnc1N1CCN(CCCc2c[nH]c3ccc(F)cc23)CC1

MAR-TRE-3724962b-29
0.345

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

MAK-UNK-37f1d6fa-3
0.330

View
O=C(Nc1ccc(C(=O)NCCc2c[nH]c3ccc(F)cc23)cc1)Nc1cccnc1

MAK-UNK-37f1d6fa-7
0.322

View
O=C(Cc1c[nH]c2ncccc12)N1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1

MAK-UNK-10572812-9
0.319

View
CC(=O)NC(Cc1c[nH]c2ccc(F)cc12)N1CCN(C(=O)Cc2c[nH]c3ncccc23)CC1

MAK-UNK-10572812-2
0.316

View
CN1CCN(C(=O)Cc2c(C(=O)NCCc3c[nH]c4ccc(F)cc34)[nH]c3ncccc23)CC1

MAK-UNK-10572812-14
0.316

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

MAK-UNK-37f1d6fa-4
0.315

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O=C(Nc1cccnc1)Nc1cccc(C(=O)NCCc2c[nH]c3ccc(F)cc23)c1

MAK-UNK-37f1d6fa-6
0.315

View
CNS(=O)(=O)Cc1ccc2[nH]cc(CCN(C)C)c2c1

TOM-OIS-cbf37265-2
0.314

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CNS(=O)(=O)Cc1ccc2[nH]cc(CCN(C)C)c2c1

LON-WEI-b8d98729-34
0.314

View
CNS(=O)(=O)Cc1ccc2[nH]cc(CCN(C)C)c2c1

ANT-OPE-47f3bb65-1
0.314

View
CN1CCN(C(=O)Cc2c[nH]c3nc(C(=O)NCCc4c[nH]c5ccc(F)cc45)ccc23)CC1

MAK-UNK-10572812-17
0.312

View
CN1CCN(C(=O)C(C(=O)NCCc2c[nH]c3ccc(F)cc23)c2c[nH]c3ncccc23)CC1

MAK-UNK-10572812-3
0.310

View
CN1CCN(C(=O)Cc2c[nH]c3nccc(C(=O)NCCc4c[nH]c5ccc(F)cc45)c23)CC1

MAK-UNK-10572812-15
0.309

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

MAK-UNK-37f1d6fa-1
0.309

View
COc1ccc2[nH]cc(CN(C)C)c2c1

DAR-DIA-eace69ff-35
0.306

View
O=C(CN1CCN(C(=O)Cc2c[nH]c3ncccc23)CC1)NCCc1c[nH]c2ccc(F)cc12

MAK-UNK-10572812-8
0.306

View
CN1CCN(C(=O)Cc2c[nH]c3ncc(C(=O)NCCc4c[nH]c5ccc(F)cc45)cc23)CC1

MAK-UNK-10572812-16
0.306

View
O=C1NC(Cc2c[nH]c3ccc(F)cc23)N2CCN(CC2)C(=O)C1c1c[nH]c2ncccc12

MAK-UNK-10572812-4
0.303

View
COc1ccc2[nH]cc(CCN)c2c1

JOH-MSK-a63bdd1d-7
0.302

View
CN1CCN(C(=O)Cc2c[nH]c3ncccc23)CC1C(=O)NCCc1c[nH]c2ccc(F)cc12

MAK-UNK-10572812-7
0.301

View
CN1CCN(C(=O)Cc2c[nH]c3ncccc23)C(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1

MAK-UNK-10572812-6
0.301

View
CN(C)CCc1c[nH]c2ccc(O)cc12

JOH-MSK-a63bdd1d-9
0.297

View
CN(C)CCc1c[nH]c2ccc(O)cc12

MAR-UCB-195bc32d-19
0.297

View
CC(=O)NCCc1c[nH]c2ccc(C#N)cc12

JOH-MEM-4bb7e4cc-1
0.296

View
CC(=O)NCCc1c[nH]c2ccc(C#N)cc12

DUN-NEW-f8ce3686-12
0.296

View
CC(=O)NCCc1c[nH]c2ccc(C#N)cc12

MAT-GIT-deadff56-1
0.296

View
O=CCc1c[nH]c2ccc(O)cc12

JOH-MEM-5e386bbd-7
0.295

View
CC(=O)NCCc1c[nH]c2ccc(O)cc12

JOH-MSK-a63bdd1d-4
0.294

View
CC(=O)NCCc1c[nH]c2ccc(O)cc12

MAR-UCB-195bc32d-16
0.294

View
CC(=O)NCCc1c[nH]c2ccc(Cl)cc12

SAN-PRS-3c4a6997-1
0.290

View
COc1ccc2[nH]cc(CCN(C)C)c2c1

MAR-UCB-195bc32d-23
0.288

View
C=CC(=O)N1CC(NCc2c[nH]c3ccc(C#N)cc23)C1

JAN-GHE-c863d918-1
0.284

View
COc1ccc2[nH]cc(CCNC(C)=O)c2c1

MAR-UCB-195bc32d-21
0.282

View
COc1ccc2[nH]cc(CCNC(C)=O)c2c1

JOH-MSK-35a8745a-1
0.282

View
COc1ccc2[nH]cc(CCNS(C)(=O)=O)c2c1

MAR-UNI-9ca61fdc-1
0.282

View
COc1ccc2[nH]cc(CCNC(C)=O)c2c1

ALE-ACE-2610ee4d-1
0.282

View
CN(C)CCc1c[nH]c2ccc(S(N)(=O)=O)cc12

ANT-OPE-47f3bb65-4
0.275

View
O=C(CCl)N1CCN(Cc2cccc(CCCNc3c[nH]c4ccc(F)cc34)c2)CC1

MAK-UNK-176ca439-7
0.274

View
CC(=O)NCCc1c(O)[nH]c2ccc(F)cc12

SAN-PRS-3c4a6997-5
0.271

View
CN(C)CCc1c[nH]c2ccc(S(=O)(=O)N(C)C)cc12

ANT-OPE-47f3bb65-5
0.271

View
O=C(NCCc1c[nH]c2ccc(Br)cc12)c1cncnc1

MAR-TRE-92684b97-67
0.269

View
C[C@H](C(=O)O)c1ccc2c(c1)[nH]c1ccc(F)cc12

MAK-UNK-0d6072ac-1
0.268

View
CCC[C@](C)(CC(=O)O)Cc1c[nH]c2ccc(C)cc12

AMI-SHA-be6e1b75-1
0.267

View
CCC[C@](C)(CC(=O)O)Cc1c[nH]c2ccc(C)cc12

AMI-SHA-0ab64bbd-1
0.267

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

MAR-UCB-195bc32d-4
0.265

View
CN(C)CCc1c[nH]c2ccc(CS(N)(=O)=O)cc12

ANT-OPE-47f3bb65-2
0.264

View
CC(=O)NCCc1c[nH]c2ccc(OS(=O)(=O)O)cc12

JOH-MSK-a63bdd1d-5
0.263

View
CC(=O)NCc1c[nH]c2c(Cc3nnc(C)s3)cc(F)cc12

SCO-VAN-260d9628-7
0.263

View
CC(=O)NCC(c1c[nH]c2ccc(F)cc12)N1CCN(C(=O)Cc2c[nH]c3ncccc23)CC1

MAK-UNK-10572812-1
0.262

View
CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N(C)C)cc12

ANT-OPE-47f3bb65-3
0.260

View
CC(=O)NCc1c[nH]c2c(Cc3nnc(C)o3)cc(F)cc12

SCO-VAN-260d9628-8
0.259

View
CC(=O)N(CCc1c[nH]c2ccc(O)cc12)c1cncnc1

MAR-TRE-85681e92-10
0.256

View
COc1ccc2[nH]cc(CCNC(=O)c3cncnc3)c2c1

MAR-TRE-be9ff7d2-73
0.256

View
CCNc1ncc(C#N)cc1NCc1c[nH]c2ccccc12

GAB-REV-df64cf17-18
0.256

View
Cn1ccn(C(Cc2c[nH]c3ccc(Br)cc23)C(=O)O)c1=[Au+]Cl

MAR-TRE-4f39ef4a-51
0.256

View
N#Cc1c[nH]c2ccc(CF)cc12

ABI-SAT-aa268ad7-2
0.254

View
CCc1c[nH]c2c(CN3CCN(C(C)=O)CC3)cc(F)cc12

BEN-VAN-d8fd1356-21
0.253

View
COC1CCN(Cc2cc(F)cc3c(CNC(C)=O)c[nH]c23)CC1

SCO-VAN-260d9628-6
0.250

View
CC(=O)NCCc1c[nH]c2ccc(OC3OC(C(=O)O)C(O)C(O)C3O)cc12

JOH-MSK-a63bdd1d-6
0.247

View
COC(=O)C(Cc1c[nH]c2ccc(Br)cc12)NC(=O)c1cncnc1

MAR-TRE-4f781e27-26
0.247

View
COc1ccc2[nH]cc(CCN(C(C)=O)c3cncnc3)c2c1

MAR-TRE-85681e92-12
0.247

View
Cc1ccc2[nH]cc(CC(Nc3cncnc3)C(=O)O)c2c1

MAR-TRE-85681e92-38
0.247

View
O=C(NCc1coc2ccc(F)cc12)c1cncnc1

MAR-TRE-e82e6c98-91
0.247

View
COc1ccc2[nH]cc(CCn3ccn(CCc4c[nH]c5ccc(OC)cc45)c3=[Au+]Cl)c2c1

MAR-TRE-d3c2bf0e-32
0.247

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

ANT-OPE-ab37bd51-2
0.247

View
O=C1NCC(c2c[nH]c3ccc(F)cc23)N2CCN(CC2)C(=O)C1c1c[nH]c2ncccc12

MAK-UNK-10572812-5
0.245

View
CC(=O)NCCc1c[nH]c2c(Cc3nc4ccccc4[nH]3)cc(F)cc12

GAB-REV-4a4e2ff3-3
0.244

View
CCC(=O)N1CCN(Cc2cc(F)cc3c(CC)c[nH]c23)CC1

BEN-VAN-d8fd1356-22
0.244

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

MAR-TRE-04c86cea-51
0.241

View
Cn1ccn(C(Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1=[Au+]Cl

MAR-TRE-4f39ef4a-50
0.241

View
O=C(NC(Cc1c[nH]c2ccc(O)cc12)C(=O)O)c1cncnc1

MAR-TRE-be9ff7d2-10
0.241

View
COc1ccc2[nH]cc(CC(Nc3cncnc3)C(=O)O)c2c1

MAR-TRE-85681e92-20
0.241

View
Cc1ccc2[nH]cc(CC(C(=O)O)n3ccn(C)c3=[Au+]Cl)c2c1

MAR-TRE-4f39ef4a-57
0.238

View
CC(=O)NCCc1c[nH]c2ccc(NC(=O)c3cncnc3)cc12

MAR-TRE-c317dd82-56
0.238

View
Cn1ccn(C(Cc2c[nH]c3ccc(O)cc23)C(=O)O)c1=[Au+]Cl

MAR-TRE-4f39ef4a-31
0.238

View
CCc1c[nH]c2c(OC3CCN(C(C)=O)CC3)cc(F)cc12

BEN-VAN-d8fd1356-25
0.237

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

TAM-UNI-c140e31a-20
0.235

View
O=C(CC1=C[NH]C2=CC=C(F)C=C12)NO

0.556

View
CCOC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.554

View
CCC(CC)(CC)NC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.552

View
CNCCNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.550

View
COC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.545

View
CCCNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.542

View
CCONC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.542

View
CCS(=O)(=O)NC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.542

View
CC(C)(C)NC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.534

View
CC(=O)NNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.534

View
CC(C)NC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.534

View
CONC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.534

View
CNC(=O)CNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.533

View
CNC(=O)NNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.533

View
CCC(CC)NC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.533

View
CS(=O)(=O)NC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.525

View
O=C(CC1=C[NH]C2=CC=C(F)C=C12)NCCCNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.525

View
CCCC(=O)NNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.525

View
CNCCCNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.524

View
CN(C)C(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.518

View
CCN(CC)C(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.517

View
CCN(C)C(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.517

View
CC(C)C(NC(=O)CC1=C[NH]C2=CC=C(F)C=C12)C(C)C

0.517

View
CN(NC(=O)CC1=C[NH]C2=CC=C(F)C=C12)C(N)=O

0.508

View
CC(C)CNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.508

View
CC(C)C(C)NC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.508

View
CC(C)(C)CNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.508

View
CC(C)(C)C(C)(C)NC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.508

View
CNC(=O)[C@H](C)NC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.508

View
CNC(=O)[C@@H](C)NC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.508

View
CCC(CC)CNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.508

View
CNCC(C)CNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.508

View
CNCCN(C)C(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.500

View
Br.CNC(=NCCCC1=C[NH]C2=CC=C(F)C=C12)NC

0.500

View
CC(CNC(=O)CC1=C[NH]C2=CC=C(F)C=C12)CNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.500

View
O=C(CC1=C[NH]C2=CC=C(F)C=C12)NC1CC1

0.500

View
CCCOC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.500

View
CCC(CC)NCCCC1=C[NH]C2=CC=C(F)C=C12

0.500

View
CNC(=O)CCNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.500

View
CC(F)(F)CNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.500

View
CCS(=O)(=O)NCCCC1=C[NH]C2=CC=C(F)C=C12

0.500

View
CNC(=O)NCCNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.492

View
CNC(=O)COC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.492

View
CC(=O)NCCNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.492

View
CC(N)CNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.492

View
C[C@@H](N)CNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.492

View
O=C(CC1=C[NH]C2=CC=C(F)C=C12)NC1=CC=C(F)C=C1

0.492

View
NCCNC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.492

View
CN(CCN(C)C(=O)CC1=C[NH]C2=CC=C(F)C=C12)C(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.492

View
CC(C)OC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.492

View
CNS(=O)(=O)NCCCC1=C[NH]C2=CC=C(F)C=C12

0.484

View
CNC(=S)NCCCC1=C[NH]C2=CC=C(F)C=C12

0.484

View
CNC(=O)NCCCC1=C[NH]C2=CC=C(F)C=C12

0.484

View
Br.CNC(N)=NCCCC1=C[NH]C2=CC=C(F)C=C12

0.484

View
CC(O)CN(C)NC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.484

View
CS(=O)(=O)NCCCC1=C[NH]C2=CC=C(F)C=C12

0.484

View
O=C(CC1=C[NH]C2=CC=C(F)C=C12)NCC1=CC=C(F)C=C1

0.484

View
CC(=O)NCCCC1=C[NH]C2=CC=C(F)C=C12

0.484

View
O=C(CC1=C[NH]C2=CC=C(F)C=C12)OCCOC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.483

View
CCCCN(C)NC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.478

View
CNCCCN(C)C(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.478

View
CNC(=O)CN(C)C(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.477

View
CC1(CNC(=O)CC2=C[NH]C3=CC=C(F)C=C23)CC1

0.477

View
CNC(=O)C(C)OC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.477

View
CNC(=O)[C@H](C)OC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.477

View
CNC(=O)[C@@H](C)OC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.477

View
CC(C)CNCCCC1=C[NH]C2=CC=C(F)C=C12

0.476

View
CCCCOC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.476

View
CC(C)(C)CNCCCC1=C[NH]C2=CC=C(F)C=C12

0.476

View
CC(C)C(C)NCCCC1=C[NH]C2=CC=C(F)C=C12

0.476

View
NC(=O)CN(CC(N)=O)C(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.475

View
CNCCCNC(=O)NCCCC1=C[NH]C2=CC=C(F)C=C12

0.471

View
CNCCNC(=O)NCCCC1=C[NH]C2=CC=C(F)C=C12

0.471

View
CNC(=O)OCCOC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.470

View
CNC(=O)C(=O)NCCCC1=C[NH]C2=CC=C(F)C=C12

0.470

View
CNC(=O)CCOC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.470

View
CC(NC(=O)CC1=C[NH]C2=CC=C(F)C=C12)C1=CC=C(F)C=C1

0.470

View
CCC(O)CNCCCC1=C[NH]C2=CC=C(F)C=C12

0.470

View
CC[C@H](O)CNCCCC1=C[NH]C2=CC=C(F)C=C12

0.470

View
CCN(CC(N)=O)C(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.469

View
O=C(CC1=C[NH]C2=CC=C(F)C=C12)NCC1=C(F)C(F)=C(F)C(F)=C1F

0.469

View
O=C(CC1=C[NH]C2=CC=C(F)C=C12)NCC1=CC(F)=CC(F)=C1

0.469

View
COCCOC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.468

View
FC1=CC=C(CNCCCC2=C[NH]C3=CC=C(F)C=C23)C=C1

0.462

View
O=C(CC1=C[NH]C2=CC=C(F)C=C12)NCC1=CC=C(F)C=C1F

0.462

View
NC(=O)NC1=CC=C(NC(=O)CC2=C[NH]C3=CC=C(F)C=C23)C=C1

0.462

View
CN(CC(N)=O)C(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.460

View
NS(=O)(=O)NCCCC1=C[NH]C2=CC=C(F)C=C12

0.460

View
CC(C)CN(CC(C)C)C(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.460

View
CNCC1=CC=C(CNC(=O)NCCCC2=C[NH]C3=CC=C(F)C=C23)C=C1

0.459

View
O=C(CC1=C[NH]C2=CC=C(F)C=C12)OCCCOC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.459

View
CC1CC(NCCCC2=C[NH]C3=CC=C(F)C=C23)C1

0.455

View
CNC(=O)NCCOC(=O)CC1=C[NH]C2=CC=C(F)C=C12

0.449

View
CC1(CNCCCC2=C[NH]C3=CC=C(F)C=C23)CC1

0.448

View
CNCC1=CC=C(NC(=O)NCCCC2=C[NH]C3=CC=C(F)C=C23)C=C1

0.442

View
FC1=CC=C2[NH]C=C(CCCNC3CCCC3)C2=C1

0.439

View
CC1CCC(NCCCC2=C[NH]C3=CC=C(F)C=C23)C1

0.429

View
FC1=CC=C2[NH]C=C(CCCNCC3=CC=CC=C3F)C2=C1

0.429

View
CC1(CCOC(=O)CC2=C[NH]C3=CC=C(F)C=C23)CC1

0.420

View
NC1CCC(NCCCC2=C[NH]C3=CC=C(F)C=C23)CC1

0.414

View
CNCc1c[nH]c2ccc(F)cc12

1.000

View
NCc1c[nH]c2ccc(F)cc12

0.583

View
Cl.NCc1c[nH]c2ccc(F)cc12

0.571

View
CN(C)Cc1c[nH]c2ccc(F)cc12

0.569

View
Fc1ccc2[nH]cc(CN3CCNCC3)c2c1

0.459

View
CN(C)C(=O)c1c[nH]c2ccc(F)cc12

0.367

View
CN(C)Cc1c[nH]c2cc(F)ccc12

0.311

View
NCc1c[nH]c2cc(F)c(F)cc12

0.254

View
NCc1c[nH]c2c(F)cccc12

0.206

View
C(NCC1C2=C(C=CC=C2)NC=1)(=O)C

0.800

View
C(NCC1C2=C(C=CC=C2)NC=1)(=O)CC

0.781

View
C(NCC1C2=C(C=CC=C2)NC=1)(=O)CC=C

0.766

View
C(NCC1C2=C(C=CC=C2)NC=1)(=O)CC#N

0.763

View
C(NCC1C2=C(C=CC=C2)NC=1)(=O)CCC

0.763

View

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