Molecular Properties | |
SMILES: | C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)NC(C)(C)C)c1cncc(OC)c1C |
MW: | 437.584 |
Fraction sp3: | 0.42 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 6 |
TPSA: | 71.53 |
cLogP: | 4.87112 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Source | |
MolPort: | MolPort-047-480-275 |
Order Status | |
Shipped: | 2020-05-13 |
Long aliphatic chain
AAR-POS-d2a4d1df-1
LON-WEI-adc59df6-55
0.714
LON-WEI-adc59df6-51
0.637
LON-WEI-adc59df6-61
0.633
LON-WEI-adc59df6-50
0.605
LON-WEI-adc59df6-52
0.586
LON-WEI-adc59df6-56
0.585
LON-WEI-adc59df6-58
0.571
RIT-AID-a497c99f-1
0.550
LON-WEI-adc59df6-54
0.548
LON-WEI-adc59df6-49
0.537
LON-WEI-adc59df6-57
0.534
LON-WEI-adc59df6-53
0.529
LON-WEI-adc59df6-48
0.524
LON-WEI-8f408cad-8
0.524
LON-WEI-adc59df6-60
0.523
ALP-POS-02c6a514-13
0.462
RAL-MED-9a5eb9cb-12
0.456
ERI-UCB-fbdd3ea1-4
0.456
DAR-DIA-2b784ede-37
0.440
DAR-DIA-2b784ede-40
0.440
LON-WEI-adc59df6-18
0.439
DAR-DIA-2b784ede-41
0.433
LON-WEI-adc59df6-3
0.432
LON-WEI-adc59df6-26
0.432
DAR-DIA-2b784ede-38
0.426
LON-WEI-b8d98729-10
0.426
LON-WEI-adc59df6-82
0.426
LON-WEI-adc59df6-27
0.423
DAR-DIA-2b784ede-39
0.422
LON-WEI-adc59df6-91
0.421
LON-WEI-d1c9908a-7
0.418
LON-WEI-adc59df6-21
0.418
LON-WEI-adc59df6-37
0.416
LON-WEI-adc59df6-12
0.416
LON-WEI-adc59df6-45
0.413
LON-WEI-adc59df6-30
0.413
LON-WEI-adc59df6-1
0.410
LON-WEI-d1c9908a-3
0.408
LON-WEI-adc59df6-44
0.404
LON-WEI-adc59df6-80
0.398
LON-WEI-adc59df6-14
0.396
LON-WEI-adc59df6-31
0.396
LON-WEI-adc59df6-29
0.396
LON-WEI-b8d98729-6
0.394
LON-WEI-b8d98729-7
0.394
LON-WEI-adc59df6-5
0.392
LON-WEI-adc59df6-2
0.392
LON-WEI-adc59df6-24
0.390
LON-WEI-adc59df6-36
0.390
LON-WEI-adc59df6-9
0.388
LON-WEI-adc59df6-17
0.388
LON-WEI-adc59df6-35
0.388
LON-WEI-adc59df6-42
0.388
LON-WEI-d1c9908a-1
0.385
LON-WEI-adc59df6-7
0.385
LON-WEI-d1c9908a-9
0.385
LON-WEI-adc59df6-28
0.384
LON-WEI-adc59df6-46
0.382
LON-WEI-babf2c61-2
0.381
LON-WEI-adc59df6-41
0.380
LON-WEI-adc59df6-8
0.380
LON-WEI-adc59df6-6
0.377
LON-WEI-adc59df6-10
0.376
LON-WEI-adc59df6-40
0.376
LON-WEI-d1c9908a-10
0.375
LON-WEI-adc59df6-15
0.375
ERI-UCB-fbdd3ea1-27
0.375
LON-WEI-adc59df6-95
0.374
LON-WEI-adc59df6-87
0.373
LON-WEI-adc59df6-39
0.373
LON-WEI-adc59df6-16
0.371
LON-WEI-adc59df6-20
0.369
RIT-AID-af4ac3d4-1
0.369
LON-WEI-adc59df6-19
0.368
ALP-POS-c59291d4-6
0.367
LON-WEI-adc59df6-73
0.367
LON-WEI-adc59df6-84
0.366
LON-WEI-adc59df6-23
0.365
LON-WEI-adc59df6-70
0.365
LON-WEI-babf2c61-4
0.364
ERI-UCB-fbdd3ea1-15
0.364
LON-WEI-adc59df6-78
0.363
LON-WEI-adc59df6-22
0.362
LON-WEI-adc59df6-33
0.362
LON-WEI-adc59df6-34
0.362
RAL-MED-9a5eb9cb-10
0.362
LON-WEI-8f408cad-9
0.360
NIM-NMI-8bb27a2b-19
0.360
DAR-DIA-2b784ede-4
0.358
LON-WEI-babf2c61-1
0.358
LON-WEI-b8d98729-32
0.357
DAR-DIA-2b784ede-3
0.357
JAN-GHE-d851b096-8
0.357
LON-WEI-b8d98729-27
0.356
LON-WEI-adc59df6-65
0.356
LON-WEI-adc59df6-32
0.355
LON-WEI-adc59df6-47
0.355
PAU-WEI-5b8d5051-1
0.355
LON-POS-586a7c45-1
0.355
LON-WEI-adc59df6-11
0.355