Molecular Properties | |
SMILES: | C=CC(=O)N(c1ccc(C2(C)CC2)cc1)C(C(=O)Nc1cccc(F)c1C)c1cccnc1 |
MW: | 443.522 |
Fraction sp3: | 0.22 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 7 |
TPSA: | 62.3 |
cLogP: | 5.47962000000001 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Source | |
Enamine SCR: | Z4444602592 |
Order Status | |
Shipped: | 2020-04-27 |
AAR-POS-d2a4d1df-1
LON-WEI-d1c9908a-9
0.756
LON-WEI-b8d98729-36
0.716
LON-WEI-d1c9908a-4
0.646
LON-WEI-d1c9908a-2
0.642
LON-WEI-d1c9908a-1
0.633
LON-WEI-d1c9908a-11
0.632
LON-WEI-d1c9908a-8
0.626
LON-WEI-d1c9908a-6
0.620
LON-WEI-d1c9908a-5
0.619
LON-WEI-adc59df6-9
0.602
LON-WEI-adc59df6-42
0.515
LON-WEI-adc59df6-33
0.510
LON-WEI-adc59df6-16
0.505
LON-WEI-b8d98729-19
0.500
LON-WEI-b8d98729-41
0.500
LON-WEI-b8d98729-28
0.491
LON-WEI-adc59df6-18
0.490
NIM-NMI-8bb27a2b-22
0.490
LON-WEI-b8d98729-40
0.481
LON-WEI-adc59df6-34
0.481
LON-WEI-d1c9908a-12
0.481
LON-WEI-b8d98729-8
0.477
LON-WEI-b8d98729-37
0.477
LON-WEI-adc59df6-46
0.476
LON-WEI-adc59df6-41
0.476
RAL-MED-9a5eb9cb-9
0.475
LON-WEI-b8d98729-29
0.472
LON-WEI-d1c9908a-3
0.472
LON-WEI-b8d98729-24
0.471
LON-WEI-adc59df6-80
0.469
PET-UNK-48ab5cd7-5
0.469
LON-WEI-b8d98729-6
0.465
LON-WEI-b8d98729-7
0.465
RAL-MED-9a5eb9cb-12
0.465
ERI-UCB-fbdd3ea1-4
0.465
RAL-MED-9a5eb9cb-10
0.464
LON-WEI-8f408cad-8
0.464
LON-WEI-adc59df6-45
0.464
LON-WEI-b8d98729-2
0.463
NIM-NMI-8bb27a2b-21
0.463
LON-WEI-b8d98729-12
0.462
LON-WEI-adc59df6-44
0.460
LON-WEI-b8d98729-39
0.459
ERI-UCB-fbdd3ea1-2
0.459
ERI-UCB-fbdd3ea1-1
0.459
LON-WEI-adc59df6-3
0.458
LON-WEI-b8d98729-22
0.458
JAN-GHE-d851b096-4
0.457
NIM-NMI-8bb27a2b-17
0.455
LON-WEI-b8d98729-17
0.455
LON-WEI-b8d98729-33
0.454
LON-WEI-adc59df6-15
0.454
LON-WEI-d1c9908a-10
0.454
LON-WEI-b8d98729-47
0.453
BRU-LEF-973da26b-1
0.452
LON-WEI-b8d98729-10
0.451
LON-WEI-adc59df6-14
0.451
LON-WEI-b8d98729-45
0.450
LON-WEI-b8d98729-13
0.450
LON-WEI-b8d98729-27
0.449
BRU-LEF-8bac3ce8-1
0.448
LON-WEI-adc59df6-91
0.447
LON-WEI-b8d98729-35
0.444
LON-WEI-adc59df6-5
0.444
LON-WEI-adc59df6-21
0.444
LON-WEI-d1c9908a-7
0.443
LON-WEI-adc59df6-35
0.442
LON-WEI-adc59df6-95
0.442
LON-WEI-adc59df6-24
0.441
LON-WEI-adc59df6-12
0.440
LON-WEI-adc59df6-30
0.440
NIM-NMI-8bb27a2b-16
0.438
RAL-MED-9a5eb9cb-15
0.438
LON-WEI-adc59df6-4
0.438
LON-WEI-adc59df6-82
0.437
RIT-AID-af4ac3d4-1
0.435
LON-WEI-adc59df6-8
0.434
LON-WEI-b8d98729-26
0.434
NIM-NMI-8bb27a2b-15
0.430
LON-WEI-adc59df6-11
0.430
NIM-NMI-8bb27a2b-24
0.429
NIM-NMI-8bb27a2b-19
0.429
LON-WEI-adc59df6-37
0.427
NIM-NMI-8bb27a2b-25
0.427
LON-WEI-adc59df6-39
0.426
LON-WEI-adc59df6-87
0.426
NIM-NMI-8bb27a2b-18
0.426
NIM-NMI-8bb27a2b-23
0.426
LON-WEI-adc59df6-43
0.425
LON-WEI-adc59df6-29
0.423
LON-WEI-adc59df6-31
0.423
LON-WEI-b8d98729-30
0.421
LON-POS-586a7c45-1
0.420
PAU-WEI-5b8d5051-1
0.420
LON-WEI-adc59df6-47
0.420
LON-WEI-adc59df6-23
0.418
LON-WEI-adc59df6-83
0.418
LON-WEI-adc59df6-78
0.417
LON-WEI-babf2c61-9
0.416
NIM-NMI-8bb27a2b-26
0.416