Molecule Details

Molecular Properties
SMILES:
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCCCOC)c1cccnc1
MW: 409.53
Fraction sp3: 0.38
HBA: 4
HBD: 1
Rotatable Bonds: 9
TPSA: 71.53
cLogP: 3.7921
Covalent Warhead: ✔️
Covalent Fragment:
Source
Enamine SCR: Z4457849214
Activity Data
Average Inhibition @ 20 µM - Fluorescence: 3.348691
Average Inhibition @ 50 µM - Fluorescence: 19.37814
Average Inhibition @ 20 µM - RapidFire: 12.2478498929666
Average Inhibition @ 50 µM - RapidFire: 39.5364589608403
Relative Solubility @ 20 µM: 0.99
Relative Solubility @ 100 µM: 0.98
Order Status
Shipped: 2020-05-13

Aliphatic long chain

Long aliphatic chain

Unbranched chain

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

LON-WEI-adc59df6-26
0.842

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

LON-WEI-adc59df6-10
0.765

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

LON-WEI-adc59df6-29
0.747

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

LON-WEI-adc59df6-7
0.741

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

LON-WEI-adc59df6-30
0.740

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

LON-WEI-adc59df6-17
0.728

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

LON-WEI-adc59df6-2
0.698

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

LON-WEI-adc59df6-3
0.688

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

LON-WEI-adc59df6-28
0.679

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

NIM-NMI-8bb27a2b-16
0.679

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

LON-WEI-8f408cad-8
0.671

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

LON-WEI-adc59df6-22
0.670

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

LON-WEI-adc59df6-36
0.663

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

LON-WEI-adc59df6-40
0.663

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

LON-WEI-adc59df6-21
0.662

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

LON-WEI-adc59df6-47
0.656

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

LON-WEI-adc59df6-25
0.648

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

LON-WEI-adc59df6-20
0.648

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

LON-WEI-adc59df6-31
0.643

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

LON-WEI-adc59df6-23
0.640

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

LON-WEI-adc59df6-44
0.639

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

NIM-NMI-8bb27a2b-19
0.628

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

NIM-NMI-8bb27a2b-24
0.628

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

LON-WEI-d1c9908a-7
0.625

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

LON-WEI-adc59df6-14
0.624

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

LON-WEI-adc59df6-19
0.620

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

LON-WEI-adc59df6-32
0.620

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

LON-WEI-adc59df6-37
0.615

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

LON-WEI-adc59df6-1
0.611

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

LON-WEI-adc59df6-18
0.611

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

LON-WEI-adc59df6-35
0.609

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

LON-WEI-adc59df6-42
0.609

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
0.600

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

LON-WEI-adc59df6-12
0.598

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

LON-WEI-adc59df6-8
0.596

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

LON-WEI-adc59df6-41
0.596

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

LON-WEI-adc59df6-46
0.593

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

LON-WEI-adc59df6-45
0.589

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

LON-WEI-d1c9908a-3
0.585

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC1CCOCC1)c1cccnc1

LON-WEI-adc59df6-39
0.582

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

NIM-NMI-8bb27a2b-18
0.582

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

LON-WEI-adc59df6-34
0.581

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

LON-WEI-d1c9908a-10
0.581

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
0.579

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

LON-WEI-adc59df6-24
0.579

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

RAL-MED-9a5eb9cb-10
0.571

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

LON-WEI-adc59df6-5
0.570

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

RAL-MED-9a5eb9cb-12
0.570

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

ERI-UCB-fbdd3ea1-4
0.570

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

LON-WEI-adc59df6-9
0.564

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
0.564

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

LON-WEI-adc59df6-33
0.564

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

LON-WEI-babf2c61-9
0.562

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

LON-WEI-adc59df6-91
0.562

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

LON-WEI-adc59df6-16
0.558

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

LON-WEI-d1c9908a-9
0.558

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

LON-WEI-adc59df6-82
0.551

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

NIM-NMI-8bb27a2b-20
0.548

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

LON-WEI-adc59df6-4
0.541

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

LON-WEI-adc59df6-43
0.541

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

LON-WEI-adc59df6-13
0.539

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

NIM-NMI-8bb27a2b-28
0.537

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

LON-WEI-b8d98729-10
0.533

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

LON-WEI-d1c9908a-12
0.531

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

LON-WEI-adc59df6-11
0.530

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

BRU-LEF-8bac3ce8-1
0.527

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

LON-WEI-b8d98729-27
0.526

View
C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NCc1cccc(Cl)c1)c1cccnc1

NIM-NMI-8bb27a2b-27
0.525

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

LON-WEI-adc59df6-80
0.523

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

NIM-NMI-8bb27a2b-17
0.522

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

LON-WEI-b8d98729-35
0.521

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

LON-WEI-adc59df6-38
0.519

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
0.517

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

LON-WEI-b8d98729-6
0.517

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

LON-WEI-b8d98729-33
0.515

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

RAL-MED-9a5eb9cb-9
0.511

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

NIM-NMI-8bb27a2b-22
0.511

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

LON-WEI-d1c9908a-1
0.505

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

LON-WEI-adc59df6-78
0.505

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

LON-WEI-b8d98729-41
0.505

View
C#CCOc1ccc(N(C(=O)C=C)C(C(=O)NC(C)(C)C)c2cccnc2)cc1

LON-WEI-adc59df6-87
0.500

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
0.500

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

RAL-MED-9a5eb9cb-15
0.500

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

NIM-NMI-8bb27a2b-2
0.500

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

LON-WEI-b8d98729-37
0.495

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

RAL-MED-9a5eb9cb-11
0.494

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

ERI-UCB-fbdd3ea1-1
0.490

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

ERI-UCB-fbdd3ea1-2
0.490

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

LON-WEI-b8d98729-39
0.490

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

NIM-NMI-8bb27a2b-15
0.490

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

LON-WEI-adc59df6-95
0.489

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

LON-WEI-b8d98729-36
0.485

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

BRU-LEF-973da26b-1
0.484

View
CC(C)(C)c1ccc(N(C(=O)c2cccnc2)C(C(=O)NCCc2cccc(F)c2)c2cccnc2)cc1

LON-WEI-2e27a2e5-2
0.480

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

NIM-NMI-8bb27a2b-21
0.480

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC(C)(C)C)c1cncc(OCC)c1

LON-WEI-adc59df6-57
0.479

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC(C)(C)C)c1cncc(OC)c1

LON-WEI-adc59df6-58
0.478

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCCc1cccc(F)c1)c1cncc(C)c1

LON-WEI-babf2c61-2
0.475

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

LON-WEI-b8d98729-19
0.475

View
C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NCCc1cccc(F)c1)c1cncc(O)c1

LON-WEI-babf2c61-4
0.471

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

0.481

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

0.472

View
COCCCNC(=S)N(C)NC(=O)C(O)C1=CC=CN=C1

0.462

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

0.446

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

0.442

View
COCCCNC(=S)N(C)NC(=O)C(C1=CC=CN=C1)C(C)C

0.436

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

0.435

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

0.432

View
COCCCNC(=O)CNC(C1=CC=CN=C1)C(C)(C)CO

0.430

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

0.427

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

0.427

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

0.425

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

0.422

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

0.422

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

0.420

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

0.420

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

0.418

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

0.418

View
COC(=O)C(C1=CC=CN=C1)N(C)CC1=CC=C(C(C)(C)C)C=C1

0.416

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

0.416

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

0.415

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

0.414

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

0.413

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

0.413

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

0.412

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

0.412

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

0.411

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

0.411

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

0.409

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

0.409

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

0.407

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

0.402

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

0.402

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

0.402

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

0.402

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

0.402

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

0.398

View
COCCCNC(=O)C(C)NC1=CC=C(C(C)(C)C)C=C1

0.398

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

0.396

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

0.396

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

0.394

View
COCCCNC(=O)C(C)N1CCN(C(=O)NC(C)C2=CC=CN=C2)CC1

0.394

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

0.394

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

0.394

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

0.393

View
COCCCNC(=O)C(C)N1CCN(C(C(=O)OC)C2=CC=CN=C2)CC1

0.392

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

0.391

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

0.391

View
COCCCNC(=O)CNC(C1=CC=CC=C1)C1=CC=CN=C1

0.389

View
COCCCNC(=O)C(C)N1CCN(C(=O)NCC(C2=CC=CN=C2)C(C)C)CC1

0.388

View
COCCCNC(=O)C(C#N)C(=O)C1=CC=CN=C1

0.386

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

0.386

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

0.386

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

0.386

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

0.385

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

0.385

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

0.384

View
COCCCNC(=O)C(C)N1CCN(C(=O)C(=O)NC(C)C2=CC=CN=C2)CC1

0.382

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

0.380

View
COCCCNC(=O)C(C#N)C(=O)CC1=CC=CN=C1

0.380

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

0.380

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

0.379

View
CC(C)C(C(=O)NCCOC1=CC=C(C(C)(C)C)C=C1)C1=CC=CN=C1

0.379

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

0.378

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

0.376

View
COCCCNC(=O)C(C#N)C(=O)C1=CC=C(C(C)(C)C)C=C1

0.375

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

0.375

View
COCCCNC(=O)C(C)N[C@@H](C)C1=CC=C(C(C)(C)C)C=C1

0.375

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

0.374

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

0.374

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

0.374

View
COCCCNC(=O)C(C)N(C)CC1=CC=CN=C1

0.374

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

0.370

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

0.370

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

0.367

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

0.364

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

0.363

View
COCCCNC(=O)C(C)N1CCN(C2CC(=O)N(C(C)C3=CC=CN=C3)C2=O)CC1

0.360

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

0.359

View
COCCCNC(=O)C(C#N)C(=O)CSC1=CC=C(C(C)(C)C)C=C1

0.358

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

0.358

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

0.356

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

0.356

View
COCCCNC(=O)C(C)SC(C)C1=CC=C(C(C)(C)C)C=C1

0.356

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

0.354

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

0.352

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

0.351

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

0.351

View
COCCCNC(=O)C(C#N)C(=O)C=CC1=CC=CN=C1

0.351

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

0.347

View
COCCCNC(=O)C(C#N)C(=O)C=CC1=CC=C(C(C)(C)C)C=C1

0.344

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

0.344

View
COCCCNC(=O)C(C#N)C(=O)C1=CC=C(C(C)(C)C)C=N1

0.340

View
COCCCNC(=O)C(C#N)C(=O)CCC1=CC=C(C(C)(C)C)C=C1

0.337

View
COCCCNC(=O)C(C#N)C(=O)COCC1=CC=CN=C1

0.337

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

0.333

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

0.330

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

0.326

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

0.323

View
COCCCNC(=O)C(C#N)C(=O)C1=CC=C(C2=CC=C(C(C)(C)C)C=C2)O1

0.320

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

0.671

View


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