Molecule Details

C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC1CCOCC1)c1cccnc1
3-aminopyridine-like Enamine Assayed
View on Fragalysis x3117
Molecular Properties
SMILES:
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC1CCOCC1)c1cccnc1
MW: 421.541
Fraction sp3: 0.4
HBA: 4
HBD: 1
Rotatable Bonds: 6
TPSA: 71.53
cLogP: 3.9346
Covalent Warhead: ✔️
Covalent Fragment:
Source
Enamine SCR: Z4457849226
Activity Data
Average Inhibition @ 20 µM - Fluorescence: 9.005827
Average Inhibition @ 50 µM - Fluorescence: 0.6676884
Average Inhibition @ 20 µM - RapidFire: 0.8409547847832
Average Inhibition @ 50 µM - RapidFire: 31.0886910790132
Relative Solubility @ 20 µM: 0.99
Relative Solubility @ 100 µM: 1.0
Order Status
Shipped: 2020-05-13

Long aliphatic chain

C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC1CC1)c1cccnc1

LON-WEI-adc59df6-44
0.840

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC1CCC1)c1cccnc1

LON-WEI-adc59df6-14
0.818

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC1CCCC1)c1cccnc1

LON-WEI-adc59df6-35
0.797

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC1CCCCC1)c1cccnc1

LON-WEI-adc59df6-8
0.778

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NC1CC1)c1cccnc1

NIM-NMI-8bb27a2b-17
0.695

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC1CC(C(=O)OC)C1)c1cccnc1

LON-WEI-adc59df6-1
0.690

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC)c1cccnc1

LON-WEI-adc59df6-3
0.671

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)N[C@H]1CC[C@@H](C(=O)OC)C1)c1cccnc1

LON-WEI-adc59df6-6
0.670

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NC1CCCC1)c1cccnc1

RAL-MED-9a5eb9cb-15
0.663

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCC1CCOC1)c1cccnc1

LON-WEI-adc59df6-19
0.659

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC(C)(C)C)c1cccnc1

LON-WEI-8f408cad-8
0.654

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NC1CCCCC1)c1cccnc1

NIM-NMI-8bb27a2b-15
0.648

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC(C)C)c1cccnc1

LON-WEI-adc59df6-21
0.646

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCC)c1cccnc1

LON-WEI-adc59df6-30
0.639

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCC1CCCO1)c1cccnc1

LON-WEI-adc59df6-32
0.624

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccc(F)cc1)c1cccnc1

LON-WEI-adc59df6-41
0.618

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCCN1CCOCC1)c1cccnc1

LON-WEI-adc59df6-25
0.617

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccccc1Cl)c1cccnc1

LON-WEI-adc59df6-42
0.614

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCCOC)c1cccnc1

LON-WEI-adc59df6-26
0.614

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC(C)CC)c1cccnc1

LON-WEI-adc59df6-31
0.609

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCCN(C)C)c1cccnc1

LON-WEI-adc59df6-29
0.609

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1cccc(F)c1)c1cccnc1

LON-WEI-adc59df6-46
0.598

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCCSC)c1cccnc1

LON-WEI-adc59df6-17
0.596

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccc2c(c1)OCCO2)c1cccnc1

LON-WEI-adc59df6-4
0.594

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccc(OC)cc1)c1cccnc1

LON-WEI-d1c9908a-7
0.593

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1cccc(Br)c1)c1cccnc1

LON-WEI-adc59df6-5
0.591

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCc1cccnc1)c1cccnc1

LON-WEI-adc59df6-28
0.589

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccc(Cl)cc1F)c1cccnc1

LON-WEI-adc59df6-33
0.585

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1c(C)cccc1CC)c1cccnc1

LON-WEI-d1c9908a-10
0.585

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccc(OC)nc1)c1cccnc1

LON-WEI-adc59df6-37
0.585

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCCCOC)c1cccnc1

LON-WEI-adc59df6-27
0.582

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccccc1OC)c1cccnc1

LON-WEI-adc59df6-18
0.581

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccc(F)cc1C)c1cccnc1

LON-WEI-adc59df6-16
0.579

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccc2c(c1)OCO2)c1cccnc1

LON-WEI-adc59df6-43
0.577

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCCCSC)c1cccnc1

LON-WEI-adc59df6-10
0.576

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCc1ccncc1)c1cccnc1

LON-WEI-adc59df6-36
0.576

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCc1ccccc1)c1cccnc1

LON-WEI-adc59df6-40
0.576

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCc1ccc(F)cc1)c1cccnc1

LON-WEI-adc59df6-23
0.574

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1cccc(C(F)(F)F)c1)c1cccnc1

LON-WEI-adc59df6-15
0.568

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1cccc(Cl)c1C)c1cccnc1

LON-WEI-adc59df6-9
0.568

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1cccc(OC)c1)c1cccnc1

LON-WEI-adc59df6-12
0.568

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCCN1CCCC1)c1cccnc1

LON-WEI-adc59df6-22
0.568

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccccc1-c1ccccc1)c1cccnc1

LON-WEI-adc59df6-34
0.568

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1cccc(C(=O)OC)c1)c1cccnc1

LON-WEI-adc59df6-24
0.567

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCc1ccc(Cl)cc1)c1cccnc1

LON-WEI-adc59df6-20
0.564

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1cccc(F)c1C)c1cccnc1

LON-WEI-d1c9908a-9
0.562

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccc(OC)cc1OC)c1cccnc1

LON-WEI-adc59df6-45
0.561

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NC)c1cccnc1

RAL-MED-9a5eb9cb-10
0.558

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCCC(=O)OCC)c1cccnc1

LON-WEI-adc59df6-2
0.558

View
C=CC(=O)N(c1ccc(C2CCOC2)cc1)C(C(=O)NC(C)(C)C)c1cccnc1

LON-WEI-adc59df6-83
0.558

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NC(C)(C)C)c1cccnc1

RAL-MED-9a5eb9cb-12
0.557

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NC(C)(C)C)c1cccnc1

ERI-UCB-fbdd3ea1-4
0.557

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccc(OC)cc1C)c1cccnc1

LON-WEI-d1c9908a-3
0.557

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCCc1cccc(F)c1)c1cccnc1

LON-WEI-adc59df6-47
0.557

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccc2c(c1)CCC2)c1cccnc1

LON-WEI-adc59df6-11
0.550

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCCCC(=O)OCC)c1cccnc1

LON-WEI-adc59df6-7
0.546

View
C=CC(=O)N(c1cc(C(C)(C)C)on1)C(C(=O)NC1CC1)c1cccnc1

NIM-NMI-8bb27a2b-3
0.543

View
C=CC(=O)N(c1ccc(C(C)(C)C#N)cc1)C(C(=O)NC(C)(C)C)c1cccnc1

LON-WEI-adc59df6-82
0.538

View
C=CC(=O)N(c1ccc(C(C)(C)CC)cc1)C(C(=O)Nc1ccccc1Br)c1cccnc1

LON-WEI-d1c9908a-12
0.536

View
C=CC(=O)N(c1ccc(C(C)(C)CC)cc1)C(C(=O)Nc1ccc(Cl)cc1)c1cccnc1

LON-WEI-b8d98729-33
0.536

View
C=CC(=O)N(c1ccc(C(F)(F)CF)cc1)C(C(=O)NC(C)(C)C)c1cccnc1

LON-WEI-adc59df6-91
0.533

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)Nc1c(C)cccc1C)c1cccnc1

NIM-NMI-8bb27a2b-22
0.532

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)Nc1ccccn1)c1cccnc1

BRU-LEF-8bac3ce8-1
0.532

View
C=CC(=O)N(c1ccc(C(F)F)cc1)C(C(=O)NC(C)(C)C)c1cccnc1

LON-WEI-adc59df6-80
0.528

View
C=CC(=O)N(c1cc(C(C)(C)C)on1)C(C(=O)NC1CCC1)c1cccnc1

ERI-UCB-fbdd3ea1-7
0.526

View
C=CC(=O)N(c1ccc(C(C)(C)CC)cc1)C(C(=O)Nc1ccc(Br)cc1)c1cccnc1

LON-WEI-b8d98729-35
0.526

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NCC(=O)OC(C)(C)C)c1cccnc1

NIM-NMI-8bb27a2b-23
0.521

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)Nc1ccccc1)c1cccnc1

RAL-MED-9a5eb9cb-9
0.516

View
C=CC(=O)N(c1cc(C(C)(C)C)on1)C(C(=O)NC1CCCC1)c1cccnc1

ERI-UCB-fbdd3ea1-6
0.515

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccc(OCc2ccccc2)cc1)c1cccnc1

LON-WEI-adc59df6-13
0.514

View
C=CC(=O)N(c1ccc(C2(C)CC2)cc1)C(C(=O)NC(C)(C)C)c1cccnc1

LON-WEI-d1c9908a-1
0.511

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NCCC(C)C)c1cccnc1

NIM-NMI-8bb27a2b-24
0.511

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NCC(=O)OC)c1cccnc1

NIM-NMI-8bb27a2b-19
0.511

View
C=CC(=O)N(c1ccc(N2CCC2)cc1)C(C(=O)NC(C)(C)C)c1cccnc1

LON-WEI-adc59df6-95
0.511

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)Nc1ccccc1Br)c1cccnc1

LON-WEI-b8d98729-41
0.510

View
C=CC(=O)N(c1ccc(SC)cc1)C(C(=O)NC(C)(C)C)c1cccnc1

LON-WEI-b8d98729-6
0.505

View
C=CC(=O)N(c1ccc(S(F)(F)(F)(F)F)cc1)C(C(=O)NC(C)(C)C)c1cccnc1

LON-WEI-b8d98729-7
0.505

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NCCCC)c1cccnc1

NIM-NMI-8bb27a2b-16
0.505

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NCC(=O)OCC)c1cccnc1

NIM-NMI-8bb27a2b-18
0.505

View
C=CC(=O)N(c1cc(C(C)(C)C)on1)C(C(=O)NC1CCCCC1)c1cccnc1

NIM-NMI-8bb27a2b-1
0.505

View
C=CC(=O)N(c1cc(C(C)(C)C)on1)C(C(=O)NC1CCCCC1)c1cccnc1

ERI-UCB-fbdd3ea1-5
0.505

View
C=CC(=O)N(c1cc(C(C)(C)C)on1)C(C(=O)NC1CCN(C)CC1)c1cccnc1

ERI-UCB-fbdd3ea1-8
0.505

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)Nc1c(C)cccc1Cl)c1cccnc1

NIM-NMI-8bb27a2b-21
0.500

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)Nc1ccc(OC)cc1)c1cccnc1

LON-WEI-b8d98729-27
0.500

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1cccc(OCc2ccccc2)c1)c1cccnc1

LON-WEI-adc59df6-38
0.495

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)Nc1c(C)cccc1CC)c1cccnc1

LON-WEI-b8d98729-39
0.495

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)[C@H](C(=O)Nc1c(C)cccc1CC)c1cccnc1

ERI-UCB-fbdd3ea1-1
0.495

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)[C@@H](C(=O)Nc1c(C)cccc1CC)c1cccnc1

ERI-UCB-fbdd3ea1-2
0.495

View
C=CC(=O)N(c1ccc(C(C)(C)CC)cc1)C(C(=O)Nc1cccc(F)c1C)c1cccnc1

LON-WEI-b8d98729-36
0.490

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)Nc1ccc(OC(F)(F)F)cc1)c1cccnc1

NIM-NMI-8bb27a2b-25
0.490

View
C=CC(=O)N(c1ccc(C(C)OC)cc1)C(C(=O)NC(C)(C)C)c1cccnc1

LON-WEI-b8d98729-10
0.489

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(N)=O)c1cccnc1

RAL-MED-9a5eb9cb-11
0.483

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NCCc1cccc(F)c1)c1cccnc1

LON-WEI-babf2c61-9
0.476

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NCc1ccccc1)c1cccnc1

NIM-NMI-8bb27a2b-20
0.475

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)Nc1ccc(OC)cc1C)c1cccnc1

LON-WEI-b8d98729-37
0.471

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NCc1ccc(Cl)cc1)c1cccnc1

NIM-NMI-8bb27a2b-28
0.465

View
C=CC(=O)N(c1ccc(C2(C)CC2)cc1)C(C(=O)Nc1ccc(Cl)cc1)c1cccnc1

LON-WEI-d1c9908a-2
0.465

View
C=CC(=O)N(c1ccc(CCC#N)cc1)C(C(=O)NC(C)(C)C)c1cccnc1

LON-WEI-adc59df6-78
0.465

View
C=CC(=O)N(c1ccc(SC)cc1)C(C(=O)Nc1ccc(Cl)cc1)c1cccnc1

LON-WEI-b8d98729-24
0.465

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)Nc1ccc2ccccc2c1)c1cccnc1

NIM-NMI-8bb27a2b-26
0.462

View
O=C(NC1CCOCC1)C(O)C1=CC=CN=C1

0.476

View
CC(C)C(C(=O)NC1CCOCC1)C1=CC=CN=C1

0.459

View
CC(C)(C(=O)NC1CCOCC1)C1=CC=CN=C1

0.447

View
CC(C)C(CNC(=O)NC1CCOCC1)C1=CC=CN=C1

0.424

View
O=C(NC1CCCOCC1)C(O)C1=CC=CN=C1

0.422

View
CC(C1=CC=CN=C1)N(C)C(=O)NC1CCOCC1

0.422

View
CC(C1=CC=CN=C1)N(C)C(=O)C(=O)NC1CCOCC1

0.422

View
CC(NC(=O)NC1CCOCC1)C1=CC=CN=C1

0.416

View
CC(C)(C(=O)NC1CCCOCC1)C1=CC=CN=C1

0.413

View
CC(C)(CO)C(NCC(=O)NC1CCOCC1)C1=CC=CN=C1

0.412

View
CC(C)(C)C1=CC=C(C(N)C(=O)NC2CCOCC2)C=C1

0.412

View
CC(NC(=O)C(=O)NC1CCOCC1)C1=CC=CN=C1

0.411

View
CC(C)(CO)C(NC(=O)NC1CCOCC1)C1=CC=CN=C1

0.411

View
CC(C)C(C(=O)NC1CCCOCC1)C1=CC=CN=C1

0.409

View
CC(C)(NC(=O)C(O)C1=CC=CN=C1)C1CCOCC1

0.407

View
CC(C1=CC=CN=C1)N(C)CC(=O)NC1CCOCC1

0.404

View
CC(C)C(CNC(=O)C(=O)NC1CCOCC1)C1=CC=CN=C1

0.404

View
CC(NCC(=O)NC1CCOCC1)C1=CC=CN=C1

0.402

View
O=C(NC1CCOCC1)NC(C1=CC=CC=C1)C1=CC=CN=C1

0.398

View
CC(CC1=CC=C(C(C)(C)C)C=C1)C(=O)NC1CCOCC1

0.398

View
CC(C1=CC=CN=C1)N1CCN(C(=O)NC2CCOCC2)CC1

0.396

View
CN(CC(=O)NC1CCOCC1)CC(O)C1=CC=CN=C1

0.396

View
CC(NC(=O)C(NC1CCOCC1)C(C)C)C1=CC=CN=C1

0.396

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CC(C)C(CNC(=O)NC1CCCOCC1)C1=CC=CN=C1

0.394

View
CC(C)(C)C1=CC=C(C2CCC(NC(=O)C(O)C3=CC=CN=C3)CC2)C=C1

0.394

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CC(SCC(=O)NC1CCOCC1)C1=CC=CN=C1

0.394

View
CC(C1=CC=CN=C1)N(C)C(=O)NC1CCCOCC1

0.392

View
CC(C1=CC=CN=C1)N(C)C(=O)C(=O)NC1CCCOCC1

0.392

View
CC(C1=CC=CN=C1)N(C)C(=S)NC1CCOCC1

0.391

View
CC(OC1=CC=CN=C1)C(=O)NC1CCOCC1

0.389

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CC(OC(=O)C(NC1CCOCC1)C(C)C)C1=CC=CN=C1

0.387

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CC(C)(CO)C(NC(=O)NC1CCCOCC1)C1=CC=CN=C1

0.386

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CC(NC(=O)NC1CCCOCC1)C1=CC=CN=C1

0.385

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CC(C)C(C(=O)OCC(=O)NC1CCOCC1)C1=CC=CN=C1

0.385

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CC(C1=CC=CN=C1)N1CCN(C(=O)C(=O)NC2CCOCC2)CC1

0.384

View
CN(C)C(C(=O)NC1CCOCC1)C1=CC=CC=C1

0.384

View
CC(C)(C)C1=CC=C(N2CCC(NC(=O)C(O)C3=CC=CN=C3)CC2)C=C1

0.381

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CC(NC(=O)C(=O)NC1CCCOCC1)C1=CC=CN=C1

0.381

View
CCN(CC1CCOCC1)C(C(=O)OC)C1=CC=CN=C1

0.379

View
CN(CC(=O)NC1CCOCC1)C1=CC=C(C(C)(C)C)C=C1

0.378

View
CC(C1=CC=CN=C1)N1CCN(CC(=O)NC2CCOCC2)CC1

0.376

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O=C(NC1CCN(C2CCOCC2)CC1)C(O)C1=CC=CN=C1

0.375

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CCN(C)C(C(=O)NC1CCOCC1)C1=CC=CC=C1

0.375

View
O=C(NC1CCOCC1)NC(C1=CC=CN=C1)C1CCCCC1

0.371

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O=C(NC1CCOC1)C(O)C1=CC=CN=C1

0.371

View
CCN(CC)C(C(=O)NC1CCOCC1)C1=CC=CC=C1

0.371

View
CC(C)C(C(=O)NC1CCN(C2=CC=C(C(C)(C)C)C=C2)CC1)C1=CC=CN=C1

0.370

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O=C(NC1CCCOCC1)NC(C1=CC=CC=C1)C1=CC=CN=C1

0.370

View
CC(C1=CC=CN=C1)N(C)C(=O)C(=O)NC1CCN(C2=CC=C(C(C)(C)C)C=C2)CC1

0.369

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O=C(CNC(C1=CC=CC=C1)C1=CC=CN=C1)NC1CCOCC1

0.367

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CC(OC1=CC=C(C(C)(C)C)C=C1)C(=O)NC1CCOCC1

0.367

View
CC(C)(C)C1=CC=C(C(N)C(=O)NC2CCCOCC2)C=C1

0.366

View
CC(C)C(C(=O)NC1CCN(C2CCOCC2)CC1)C1=CC=CN=C1

0.364

View
CC(NC(=O)C(F)C1CCOCC1)C1=CC=CN=C1

0.362

View
CCN(CC1CCOCC1)C(C(=O)O)C1=CC=CN=C1

0.362

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

0.360

View
CC(C1=CC=CN=C1)N1CCN(C(=O)NC2CCCOCC2)CC1

0.359

View
CC(C)C(C(=O)NC1CCOC1)C1=CC=CN=C1

0.359

View
CC(C1=CC=CN=C1)N1CCN(C(=O)C(=O)NC2CCCOCC2)CC1

0.358

View
CCC(C)(C)C1CCC(NC(=O)C(O)C2=CC=CN=C2)CC1

0.358

View
CC(C1=CC=CN=C1)N(C)C(=O)NC1CCN(C2=CC=C(C(C)(C)C)C=C2)CC1

0.356

View
CCCC(NC1CCOCC1)C1=CC=CN=C1

0.356

View
O=C(NC1CCC2(CCOCC2)CC1)C(O)C1=CC=CN=C1

0.354

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CC(NC(=O)C(=O)NC1CCN(C2=CC=C(C(C)(C)C)C=C2)CC1)C1=CC=CN=C1

0.353

View
C[C@H](NC(=O)NC1CCOCC1)C1=CC=C(C(C)(C)C)C=C1

0.352

View
CC(NC(=O)NC1CCOCC1)C1=CC=C(C(C)(C)C)C=C1

0.352

View
CC(C)(C)C1CC(NC(=O)C(O)C2=CC=CN=C2)CCO1

0.351

View
CC(NC(=O)NC1CCN(C2=CC=C(C(C)(C)C)C=C2)CC1)C1=CC=CN=C1

0.350

View
CC(C)(C)C1=CC=C(NNC(=O)NC2CCOCC2)C=C1

0.348

View
CC(C)C(C(=O)NC1CCC2(CCOCC2)CC1)C1=CC=CN=C1

0.343

View
CC1(N2CCOCC2)CCC(NC(=O)C(O)C2=CC=CN=C2)CC1

0.343

View
CC(C1=CC=CN=C1)N1CCN(C(=O)NC2CCN(C3=CC=C(C(C)(C)C)C=C3)CC2)CC1

0.343

View
CC(NC(=O)N[C@@H]1CCOC1)C1=CC=CN=C1

0.337

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CC(NC(=O)NC1CCOC1)C1=CC=CN=C1

0.337

View
CC(C)(CO)C(NC(=O)C(F)C1CCOCC1)C1=CC=CN=C1

0.337

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COC(=O)C(NC(=O)C(F)C1CCOCC1)C1=CC=CN=C1

0.333

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CCN(CC1CCOCC1)C(=O)C(O)C1=CC=CN=C1

0.333

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CC(C)C(C(=O)NC1CC1)C1=CC=CN=C1

0.333

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CC(C)C(C(=O)NC1CCC(NC(=O)C(C2=CC=CN=C2)C(C)C)CC1)C1=CC=CN=C1

0.333

View
CC(C)C(C(=O)N[C@H]1CC[C@H](NC(=O)C(C2=CC=CN=C2)C(C)C)CC1)C1=CC=CN=C1

0.333

View
CC(C)C(C(=O)NC1CCN(C2CCOC2)CC1)C1=CC=CN=C1

0.330

View
CC(C)C(C(=O)NC1CCOC(C(C)(C)C)C1)C1=CC=CN=C1

0.330

View
O=C(NC(CO)C1=CC=CN=C1)C(F)C1CCOCC1

0.330

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COC(=O)C(NC(=O)C(C)C1CCOCC1)C1=CC=CN=C1

0.327

View
CC(C)(C)C1=CC=C(C(N)C(=O)NC2CCN(CC3=CC=CN=C3)CC2)C=C1

0.321

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CC(C)(C)C1=CC=C(C(C)(C)C(=O)NC2CCOC(C3=CC=CN=C3)C2)C=C1

0.314

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CC(C)(C)C1=CC=C(NC(=O)NC2CCOC(C3=CC=CN=C3)C2)C=C1

0.311

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CC(C)(C)C1=CC=C(C(=O)NC2CCOC(C3=CC=CN=C3)C2)C=C1

0.311

View
CC(C)(C)C1=CC=C(C(O)CNC(=O)NC2CCOC(C3=CC=CN=C3)C2)C=C1

0.310

View
CC(C(=O)NC1CC1)N1CCN(C(C)C2=CC=CN=C2)CC1

0.309

View
CC(NC(=O)NC1CCOC(C2=CC=CN=C2)C1)C1=CC=C(C(C)(C)C)C=C1

0.309

View
C[C@H](NC(=O)NC1CCOC(C2=CC=CN=C2)C1)C1=CC=C(C(C)(C)C)C=C1

0.309

View
CC(C)(C)C1=CC=C(NNC(=O)NC2CCOC(C3=CC=CN=C3)C2)C=C1

0.308

View
CC(OC1=CC=C(C(C)(C)C)C=C1)C(=O)NC1CCOC(C2=CC=CN=C2)C1

0.306

View
CN(C)C(C(=O)NC1CCOC(C2=CC=CN=C2)C1)C1=CC=CC=C1

0.302

View
CN(C(=O)C1CC(C2=CC=CN=C2)=NO1)C1=CC=C(C(C)(C)C)C=C1

0.301

View
CCN(C)C(C(=O)NC1CCOC(C2=CC=CN=C2)C1)C1=CC=CC=C1

0.300

View
CCN(CC)C(C(=O)NC1CCOC(C2=CC=CN=C2)C1)C1=CC=CC=C1

0.297

View
CC(C)(C)C1=CC=C(C(C)(C)NC(=O)NC2CCOC(C3=CC=CN=C3)C2)C=C1

0.294

View
COC(=O)C(NC(=O)C(F)C1CCOC1)C1=CC=CN=C1

0.291

View
CC(C)(C)NC(=O)C(N(C(=O)C=C)c1ccc(cc1)C(C)(C)C)c1cccnc1

0.654

View


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