Molecular Properties | |
SMILES: | C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)Nc1ccc(OC)cc1C)c1cccnc1 |
MW: | 469.463 |
Fraction sp3: | 0.16 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 7 |
TPSA: | 71.53 |
cLogP: | 5.31642 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Source | |
Mcule: | MCULE-6075509318 |
Order Status | |
Shipped: | 2020-04-09 |
AAR-POS-d2a4d1df-1
LON-WEI-d1c9908a-3
0.859
LON-WEI-b8d98729-28
0.778
LON-WEI-b8d98729-40
0.767
LON-WEI-b8d98729-8
0.758
LON-WEI-d1c9908a-4
0.742
LON-WEI-b8d98729-27
0.711
LON-WEI-b8d98729-26
0.695
LON-WEI-b8d98729-30
0.695
LON-WEI-adc59df6-16
0.670
LON-WEI-adc59df6-45
0.667
NIM-NMI-8bb27a2b-22
0.659
LON-WEI-b8d98729-41
0.652
LON-WEI-b8d98729-1
0.641
RAL-MED-9a5eb9cb-10
0.640
RAL-MED-9a5eb9cb-9
0.626
LON-WEI-b8d98729-43
0.626
NIM-NMI-8bb27a2b-25
0.625
NIM-NMI-8bb27a2b-19
0.620
NIM-NMI-8bb27a2b-21
0.619
ERI-UCB-fbdd3ea1-4
0.618
RAL-MED-9a5eb9cb-12
0.618
LON-WEI-b8d98729-39
0.612
ERI-UCB-fbdd3ea1-1
0.612
ERI-UCB-fbdd3ea1-2
0.612
LON-WEI-adc59df6-12
0.608
BRU-LEF-8bac3ce8-1
0.606
NIM-NMI-8bb27a2b-17
0.604
LON-WEI-d1c9908a-7
0.600
NIM-NMI-8bb27a2b-18
0.594
NIM-NMI-8bb27a2b-26
0.590
RIT-AID-af4ac3d4-1
0.588
LON-WEI-adc59df6-18
0.588
NIM-NMI-8bb27a2b-24
0.585
RAL-MED-9a5eb9cb-15
0.579
NIM-NMI-8bb27a2b-16
0.579
NIM-NMI-8bb27a2b-23
0.577
LON-WEI-adc59df6-33
0.576
RAL-MED-9a5eb9cb-4
0.576
LON-WEI-adc59df6-42
0.568
NIM-NMI-8bb27a2b-15
0.567
RAL-MED-9a5eb9cb-11
0.563
RAL-MED-9a5eb9cb-5
0.563
LON-WEI-adc59df6-15
0.560
LON-WEI-d1c9908a-9
0.554
BRU-LEF-973da26b-1
0.546
NIM-NMI-8bb27a2b-20
0.545
LON-WEI-adc59df6-9
0.545
LON-WEI-babf2c61-9
0.544
LON-WEI-b8d98729-12
0.540
RAL-MED-9a5eb9cb-3
0.536
NIM-NMI-8bb27a2b-28
0.535
LON-WEI-b8d98729-47
0.530
LON-WEI-adc59df6-37
0.529
LON-WEI-adc59df6-34
0.529
LON-WEI-d1c9908a-12
0.529
LON-WEI-b8d98729-36
0.528
LON-WEI-adc59df6-3
0.527
LON-WEI-adc59df6-21
0.527
LON-WEI-adc59df6-91
0.526
LON-WEI-adc59df6-41
0.525
LON-WEI-adc59df6-46
0.525
NIM-NMI-8bb27a2b-27
0.524
LON-WEI-8f408cad-8
0.516
RAL-MED-9a5eb9cb-1
0.515
LON-WEI-d1c9908a-5
0.515
LON-WEI-d1c9908a-10
0.515
LON-WEI-adc59df6-24
0.514
LON-WEI-adc59df6-44
0.510
LON-WEI-adc59df6-30
0.505
LON-WEI-adc59df6-26
0.505
LON-WEI-b8d98729-19
0.505
LON-WEI-b8d98729-35
0.505
LON-WEI-adc59df6-5
0.505
LON-WEI-8f408cad-10
0.505
LON-WEI-b8d98729-33
0.500
LON-WEI-adc59df6-31
0.500
LON-WEI-adc59df6-82
0.500
LON-WEI-adc59df6-14
0.500
LON-WEI-adc59df6-27
0.495
LON-WEI-adc59df6-35
0.490
LON-WEI-adc59df6-29
0.485
LON-WEI-adc59df6-13
0.482
LON-WEI-adc59df6-4
0.481
LON-WEI-adc59df6-43
0.481
LON-WEI-adc59df6-1
0.481
LON-WEI-adc59df6-8
0.480
LON-WEI-adc59df6-38
0.478
LON-WEI-d1c9908a-13
0.477
LON-WEI-adc59df6-2
0.476
LON-WEI-adc59df6-36
0.476
LON-WEI-adc59df6-17
0.475
LON-WEI-adc59df6-80
0.474
LON-WEI-adc59df6-11
0.473
LON-WEI-adc59df6-39
0.471
LON-WEI-adc59df6-28
0.471
LON-WEI-b8d98729-10
0.470
LON-WEI-b8d98729-7
0.469
LON-WEI-b8d98729-45
0.468
LON-WEI-adc59df6-7
0.467
LON-WEI-b8d98729-13
0.467