Molecular Properties | |
SMILES: | C=CC(=O)N(c1ccc2ncsc2c1)C(C(=O)Nc1ccc(Br)cc1)c1cccnc1 |
MW: | 493.386 |
Fraction sp3: | 0.04 |
HBA: | 5 |
HBD: | 1 |
Rotatable Bonds: | 6 |
TPSA: | 75.19 |
cLogP: | 5.3528 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Source | |
Enamine SCR: | Z4439011556 |
Order Status | |
Shipped: | 2020-04-09 |
Filter9_metal
aryl bromide
AAR-POS-d2a4d1df-1
LON-WEI-b8d98729-44
0.841
LON-WEI-b8d98729-25
0.822
LON-WEI-b8d98729-38
0.707
LON-WEI-b8d98729-31
0.703
LON-WEI-b8d98729-48
0.663
LON-WEI-b8d98729-1
0.657
LON-WEI-b8d98729-14
0.625
LON-WEI-b8d98729-35
0.598
LON-WEI-d1c9908a-11
0.588
LON-WEI-b8d98729-11
0.515
LON-WEI-b8d98729-24
0.505
LON-WEI-8f408cad-10
0.505
LON-WEI-b8d98729-47
0.500
BRU-LEF-973da26b-1
0.500
RIT-AID-af4ac3d4-1
0.495
LON-WEI-b8d98729-12
0.495
LON-WEI-adc59df6-41
0.495
LON-WEI-d1c9908a-7
0.490
LON-WEI-b8d98729-33
0.486
LON-WEI-b8d98729-27
0.481
RAL-MED-9a5eb9cb-9
0.480
LON-WEI-b8d98729-22
0.476
LON-WEI-adc59df6-5
0.476
LON-WEI-d1c9908a-2
0.476
JAN-GHE-d851b096-4
0.476
JAN-GHE-d851b096-9
0.475
LON-WEI-d1c9908a-5
0.472
NIM-NMI-8bb27a2b-25
0.472
LON-WEI-adc59df6-37
0.458
LON-WEI-adc59df6-13
0.456
ALP-POS-e980f4ea-24
0.454
LON-WEI-b8d98729-13
0.454
BRU-LEF-e1854a6f-1
0.452
BRU-THA-92256091-51
0.450
LON-WEI-adc59df6-79
0.447
NIM-NMI-8bb27a2b-26
0.445
LON-WEI-d1c9908a-12
0.444
LON-WEI-adc59df6-46
0.439
ALP-POS-ced8ea4d-24
0.434
LON-WEI-b8d98729-41
0.434
LON-WEI-adc59df6-15
0.431
LON-WEI-adc59df6-12
0.431
LON-WEI-b8d98729-16
0.430
LON-WEI-adc59df6-4
0.429
LON-WEI-adc59df6-43
0.429
LON-WEI-b8d98729-21
0.427
BRU-LEF-8bac3ce8-1
0.425
LON-WEI-b8d98729-19
0.422
LON-WEI-adc59df6-11
0.421
LON-WEI-adc59df6-24
0.420
LON-WEI-adc59df6-42
0.419
RAL-MED-9a5eb9cb-6
0.418
LON-WEI-adc59df6-3
0.418
LON-WEI-adc59df6-30
0.416
LON-WEI-adc59df6-14
0.413
LON-WEI-adc59df6-73
0.413
LON-WEI-d1c9908a-6
0.412
RAL-MED-9a5eb9cb-10
0.410
LON-WEI-b8d98729-17
0.409
LON-WEI-adc59df6-44
0.408
LON-WEI-8f408cad-9
0.406
LON-WEI-adc59df6-35
0.406
LON-WEI-adc59df6-33
0.405
LON-WEI-adc59df6-38
0.405
JAN-GHE-d851b096-8
0.404
NIM-NMI-8bb27a2b-17
0.404
LON-WEI-adc59df6-68
0.404
LON-WEI-b8d98729-42
0.404
RAL-MED-9a5eb9cb-14
0.402
RAL-MED-9a5eb9cb-15
0.402
LON-WEI-adc59df6-103
0.402
LON-WEI-b8d98729-30
0.400
LON-WEI-adc59df6-18
0.400
LON-WEI-adc59df6-84
0.398
LON-WEI-adc59df6-8
0.398
NIM-NMI-8bb27a2b-22
0.398
LON-WEI-b8d98729-6
0.398
LON-WEI-b8d98729-7
0.398
NIM-NMI-8bb27a2b-8
0.397
LON-WEI-8f408cad-8
0.396
LON-WEI-adc59df6-88
0.395
LON-WEI-b8d98729-40
0.395
NIM-NMI-8bb27a2b-15
0.394
RAL-MED-9a5eb9cb-4
0.393
LON-WEI-adc59df6-95
0.393
LON-WEI-adc59df6-21
0.392
LON-WEI-b8d98729-28
0.391
LON-WEI-adc59df6-45
0.391
LON-WEI-adc59df6-39
0.391
LON-WEI-b8d98729-32
0.390
DAR-DIA-2b784ede-53
0.389
LON-WEI-b8d98729-2
0.389
LON-WEI-adc59df6-16
0.389
NIM-NMI-8bb27a2b-21
0.389
LON-WEI-adc59df6-80
0.388
LON-WEI-b8d98729-26
0.388
LON-WEI-adc59df6-100
0.387
LON-WEI-adc59df6-104
0.387
LON-WEI-b8d98729-18
0.386
LON-WEI-b8d98729-29
0.386