Molecular Properties | |
SMILES: | C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC(C)(C)C)c1cncc(C(C)(F)F)c1 |
MW: | 457.565 |
Fraction sp3: | 0.42 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 6 |
TPSA: | 62.3 |
cLogP: | 5.66580000000001 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Order Status | |
Shipped: | 2020-05-13 |
Long aliphatic chain
AAR-POS-d2a4d1df-1
LON-WEI-adc59df6-53
0.716
LON-WEI-adc59df6-54
0.716
LON-WEI-adc59df6-58
0.697
RIT-AID-a497c99f-1
0.681
LON-WEI-adc59df6-57
0.671
LON-WEI-8f408cad-8
0.667
RAL-MED-9a5eb9cb-12
0.600
ERI-UCB-fbdd3ea1-4
0.600
LON-WEI-adc59df6-91
0.571
LON-WEI-adc59df6-48
0.562
LON-WEI-adc59df6-49
0.557
LON-WEI-adc59df6-61
0.556
LON-WEI-adc59df6-50
0.549
LON-WEI-adc59df6-51
0.542
LON-WEI-adc59df6-82
0.541
LON-WEI-adc59df6-3
0.537
LON-WEI-adc59df6-21
0.537
LON-WEI-adc59df6-55
0.536
LON-WEI-adc59df6-80
0.530
LON-WEI-b8d98729-7
0.524
LON-WEI-adc59df6-59
0.523
LON-WEI-adc59df6-30
0.512
LON-WEI-b8d98729-6
0.506
LON-WEI-adc59df6-31
0.506
LON-WEI-adc59df6-41
0.500
LON-WEI-adc59df6-44
0.500
LON-WEI-adc59df6-52
0.500
LON-WEI-babf2c61-2
0.495
LON-WEI-adc59df6-35
0.494
LON-WEI-d1c9908a-1
0.494
LON-WEI-adc59df6-56
0.494
LON-WEI-babf2c61-4
0.490
LON-WEI-adc59df6-15
0.489
LON-WEI-b8d98729-10
0.489
LON-WEI-adc59df6-29
0.489
LON-WEI-adc59df6-14
0.489
LON-WEI-adc59df6-46
0.484
LON-WEI-babf2c61-1
0.480
LON-WEI-adc59df6-42
0.478
LON-WEI-adc59df6-95
0.478
LON-WEI-adc59df6-17
0.478
LON-WEI-adc59df6-26
0.478
LON-WEI-adc59df6-33
0.474
LON-WEI-adc59df6-28
0.473
RAL-MED-9a5eb9cb-10
0.471
LON-WEI-adc59df6-16
0.469
LON-WEI-adc59df6-8
0.467
LON-WEI-adc59df6-27
0.467
LON-WEI-adc59df6-47
0.464
PAU-WEI-5b8d5051-1
0.464
LON-POS-586a7c45-1
0.464
LON-WEI-adc59df6-23
0.463
LON-WEI-adc59df6-5
0.463
LON-WEI-adc59df6-40
0.462
LON-WEI-adc59df6-10
0.462
LON-WEI-d1c9908a-7
0.462
LON-WEI-adc59df6-36
0.462
LON-WEI-adc59df6-78
0.462
LON-WEI-adc59df6-74
0.462
LON-WEI-8f408cad-9
0.462
LON-WEI-babf2c61-3
0.461
JAN-GHE-d851b096-8
0.461
LON-WEI-adc59df6-12
0.458
LON-WEI-adc59df6-39
0.457
LON-WEI-adc59df6-87
0.457
LON-WEI-adc59df6-73
0.456
LON-WEI-adc59df6-4
0.455
LON-WEI-adc59df6-7
0.454
LON-WEI-d1c9908a-9
0.454
LON-WEI-adc59df6-18
0.453
LON-WEI-adc59df6-20
0.453
LON-WEI-adc59df6-1
0.453
ERI-UCB-fbdd3ea1-16
0.452
ERI-UCB-fbdd3ea1-15
0.451
LON-WEI-d1c9908a-3
0.449
LON-WEI-adc59df6-2
0.448
LON-WEI-adc59df6-83
0.448
LON-WEI-adc59df6-79
0.446
LON-WEI-b8d98729-32
0.444
LON-WEI-adc59df6-24
0.444
LON-WEI-adc59df6-9
0.443
LON-WEI-adc59df6-34
0.443
LON-WEI-adc59df6-22
0.443
LON-WEI-d1c9908a-10
0.443
LON-WEI-adc59df6-37
0.443
ERI-UCB-fbdd3ea1-17
0.441
LON-WEI-adc59df6-103
0.441
LON-WEI-adc59df6-43
0.440
LON-WEI-adc59df6-45
0.440
ALP-POS-c59291d4-6
0.440
LON-WEI-adc59df6-70
0.438
LON-WEI-adc59df6-100
0.438
NIM-NMI-8bb27a2b-22
0.436
BRU-LEF-8bac3ce8-1
0.436
LON-WEI-babf2c61-8
0.436
LON-WEI-adc59df6-101
0.435
LON-WEI-adc59df6-32
0.434
LON-WEI-adc59df6-19
0.434
LON-WEI-adc59df6-11
0.431
NIM-NMI-8bb27a2b-19
0.430