Molecular Properties | |
SMILES: | C=CC(=O)N(c1ccc2c(c1)C=CCCC2)C(C(=O)NC(C)(C)C)c1cccnc1 |
MW: | 403.526 |
Fraction sp3: | 0.32 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 5 |
TPSA: | 62.3 |
cLogP: | 4.6061 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Order Status | |
Shipped: | 2020-05-26 |
Long aliphatic chain
AAR-POS-d2a4d1df-1
JAN-GHE-d851b096-8
0.604
LON-WEI-adc59df6-88
0.590
LON-WEI-adc59df6-73
0.581
LON-WEI-adc59df6-103
0.579
LON-WEI-d1c9908a-1
0.570
LON-WEI-adc59df6-79
0.568
LON-WEI-8f408cad-9
0.568
LON-WEI-8f408cad-8
0.567
LON-WEI-b8d98729-7
0.565
LON-WEI-adc59df6-68
0.561
LON-WEI-adc59df6-100
0.556
LON-WEI-adc59df6-80
0.554
LON-WEI-b8d98729-32
0.553
LON-WEI-adc59df6-95
0.552
LON-WEI-b8d98729-31
0.550
LON-WEI-b8d98729-6
0.548
ERI-UCB-fbdd3ea1-4
0.548
RAL-MED-9a5eb9cb-12
0.548
LON-WEI-adc59df6-70
0.548
LON-WEI-adc59df6-84
0.541
LON-WEI-adc59df6-104
0.540
LON-WEI-b8d98729-10
0.531
LON-WEI-adc59df6-82
0.531
LON-WEI-adc59df6-91
0.526
LON-WEI-adc59df6-101
0.526
LON-WEI-adc59df6-74
0.520
LON-WEI-adc59df6-78
0.520
LON-WEI-adc59df6-87
0.515
LON-WEI-adc59df6-65
0.510
LON-WEI-adc59df6-85
0.505
LON-WEI-adc59df6-83
0.505
LON-WEI-adc59df6-81
0.490
ERI-UCB-fbdd3ea1-31
0.481
ERI-UCB-fbdd3ea1-15
0.480
LON-WEI-b8d98729-23
0.475
ERI-UCB-fbdd3ea1-11
0.475
LON-WEI-adc59df6-14
0.470
ERI-UCB-fbdd3ea1-13
0.465
LON-WEI-adc59df6-21
0.464
ERI-UCB-fbdd3ea1-30
0.462
LON-WEI-adc59df6-35
0.461
LON-WEI-adc59df6-90
0.459
ERI-UCB-fbdd3ea1-17
0.456
ERI-UCB-fbdd3ea1-12
0.456
ERI-UCB-fbdd3ea1-16
0.452
LON-WEI-adc59df6-44
0.450
LON-WEI-adc59df6-3
0.448
LON-WEI-adc59df6-11
0.446
LON-WEI-adc59df6-8
0.438
ERI-UCB-fbdd3ea1-21
0.437
JAN-GHE-d851b096-9
0.433
ERI-UCB-fbdd3ea1-18
0.431
LON-WEI-adc59df6-30
0.430
RAL-MED-9a5eb9cb-15
0.429
LON-WEI-adc59df6-94
0.429
LON-WEI-adc59df6-69
0.427
LON-WEI-adc59df6-31
0.427
LON-WEI-adc59df6-72
0.426
ERI-UCB-fbdd3ea1-19
0.426
LON-WEI-adc59df6-67
0.425
RAL-MED-9a5eb9cb-10
0.424
LON-WEI-adc59df6-5
0.422
LON-WEI-adc59df6-64
0.421
ERI-UCB-fbdd3ea1-14
0.420
LON-WEI-adc59df6-26
0.419
LON-WEI-adc59df6-22
0.418
LON-WEI-adc59df6-96
0.417
LON-WEI-adc59df6-93
0.417
NIM-NMI-8bb27a2b-17
0.417
LON-WEI-adc59df6-39
0.417
LON-WEI-adc59df6-92
0.417
LON-WEI-adc59df6-77
0.416
LON-WEI-adc59df6-54
0.416
LON-WEI-adc59df6-62
0.415
LON-WEI-adc59df6-63
0.415
LON-WEI-adc59df6-71
0.415
LON-WEI-adc59df6-29
0.413
ERI-UCB-fbdd3ea1-22
0.413
LON-WEI-adc59df6-75
0.413
LON-WEI-adc59df6-97
0.413
LON-WEI-adc59df6-99
0.413
LON-WEI-adc59df6-1
0.413
LON-WEI-adc59df6-46
0.413
ERI-UCB-fbdd3ea1-23
0.413
LON-WEI-adc59df6-27
0.411
LON-WEI-adc59df6-41
0.411
LON-WEI-adc59df6-89
0.411
ERI-UCB-fbdd3ea1-20
0.411
LON-POS-586a7c45-1
0.411
PAU-WEI-5b8d5051-1
0.411
LON-WEI-adc59df6-47
0.411
NIR-WEI-f9286bb6-2
0.408
NIM-NMI-8bb27a2b-15
0.407
JAN-GHE-d851b096-4
0.407
ERI-UCB-fbdd3ea1-7
0.407
LON-WEI-adc59df6-17
0.406
LON-WEI-adc59df6-86
0.406
NIM-NMI-8bb27a2b-24
0.406
LON-WEI-adc59df6-42
0.406
LON-WEI-adc59df6-9
0.405