Molecular Properties | |
SMILES: | C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)Nc1ccc(Cl)cc1)c1cncnc1 |
MW: | 460.09 |
Fraction sp3: | 0.09 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 6 |
TPSA: | 75.19 |
cLogP: | 5.05 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2020-07-24 |
Synthesis Location: | wuxi |
Shipped: | synthesis in progress |
high halogen content (>3)
ALP-POS-568d9d36-1
0.757
RAL-MED-9a5eb9cb-9
0.607
LON-WEI-b8d98729-33
0.589
LON-WEI-b8d98729-27
0.584
NIM-NMI-8bb27a2b-25
0.571
LON-WEI-b8d98729-24
0.562
RAL-MED-9a5eb9cb-3
0.545
LON-WEI-adc59df6-41
0.533
RIT-AID-a497c99f-1
0.531
LON-WEI-b8d98729-22
0.527
LON-WEI-d1c9908a-2
0.527
NIM-NMI-8bb27a2b-28
0.527
RAL-MED-9a5eb9cb-10
0.524
NIM-NMI-8bb27a2b-26
0.505
NIM-NMI-8bb27a2b-17
0.494
RAL-MED-9a5eb9cb-12
0.489
ERI-UCB-fbdd3ea1-4
0.489
NIM-NMI-8bb27a2b-21
0.485
BRU-LEF-8bac3ce8-1
0.484
NIM-NMI-8bb27a2b-22
0.484
RAL-MED-9a5eb9cb-11
0.482
LON-WEI-b8d98729-41
0.479
LON-WEI-d1c9908a-7
0.479
LON-WEI-babf2c61-5
0.475
LON-WEI-b8d98729-11
0.474
LON-WEI-adc59df6-15
0.474
RAL-MED-9a5eb9cb-15
0.473
NIM-NMI-8bb27a2b-27
0.470
RIT-AID-af4ac3d4-1
0.469
LON-WEI-b8d98729-35
0.464
NIM-NMI-8bb27a2b-15
0.463
NIM-NMI-8bb27a2b-19
0.462
NIM-NMI-8bb27a2b-24
0.462
RAL-MED-9a5eb9cb-4
0.459
NIM-NMI-8bb27a2b-20
0.458
NIM-NMI-8bb27a2b-16
0.457
LON-WEI-b8d98729-37
0.455
LON-WEI-adc59df6-46
0.454
LON-WEI-b8d98729-39
0.450
ERI-UCB-fbdd3ea1-2
0.450
ERI-UCB-fbdd3ea1-1
0.450
JAN-GHE-d851b096-4
0.448
LON-WEI-b8d98729-44
0.447
LON-WEI-babf2c61-6
0.446
LON-WEI-babf2c61-9
0.446
NIM-NMI-8bb27a2b-23
0.443
NIM-NMI-8bb27a2b-18
0.443
LON-WEI-b8d98729-21
0.440
LON-WEI-babf2c61-8
0.437
RAL-MED-9a5eb9cb-5
0.437
LON-WEI-adc59df6-33
0.430
LON-WEI-adc59df6-53
0.429
LON-WEI-b8d98729-47
0.429
RAL-MED-9a5eb9cb-1
0.429
BRU-LEF-973da26b-1
0.427
RAL-MED-9a5eb9cb-18
0.427
LON-WEI-adc59df6-20
0.424
LON-WEI-b8d98729-12
0.424
LON-WEI-adc59df6-5
0.420
RAL-MED-9a5eb9cb-16
0.418
LON-WEI-adc59df6-13
0.417
LON-WEI-babf2c61-7
0.417
LON-WEI-adc59df6-42
0.417
LON-WEI-adc59df6-12
0.416
LON-WEI-adc59df6-37
0.416
LON-WEI-adc59df6-3
0.416
LON-WEI-adc59df6-4
0.413
LON-WEI-d1c9908a-11
0.410
LON-WEI-adc59df6-60
0.409
LON-WEI-adc59df6-91
0.406
LON-WEI-adc59df6-24
0.404
LON-WEI-adc59df6-21
0.402
LON-WEI-d1c9908a-5
0.402
LON-WEI-adc59df6-43
0.400
LON-WEI-adc59df6-16
0.398
LON-WEI-adc59df6-30
0.398
LON-WEI-babf2c61-1
0.396
LON-WEI-adc59df6-11
0.393
LON-WEI-adc59df6-23
0.392
LON-WEI-8f408cad-8
0.391
LON-WEI-adc59df6-44
0.389
LON-WEI-adc59df6-9
0.388
RAL-MED-9a5eb9cb-17
0.388
LON-WEI-d1c9908a-9
0.385
LON-WEI-adc59df6-54
0.383
LON-WEI-adc59df6-14
0.381
LON-WEI-adc59df6-31
0.381
LON-WEI-b8d98729-36
0.380
LON-WEI-adc59df6-36
0.376
LON-WEI-adc59df6-34
0.375
LON-WEI-b8d98729-14
0.375
LON-WEI-adc59df6-58
0.375
LON-WEI-d1c9908a-12
0.375
LON-WEI-adc59df6-35
0.374
JAN-GHE-d851b096-9
0.374
LON-WEI-adc59df6-39
0.373
LON-WEI-adc59df6-28
0.370
LON-WEI-adc59df6-18
0.369
PAU-WEI-5b8d5051-1
0.368
LON-WEI-adc59df6-47
0.368