Molecular Properties | |
SMILES: | O=C1NC2(COc3ccc(Cl)cc32)C(=O)N1c1cncc2ccc(F)cc12 |
MW: | 383.05 |
Fraction sp3: | 0.11 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 1 |
TPSA: | 71.53 |
cLogP: | 3.37 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 1.38413747648093 |
Order Status | |
Shipped: | 2021-04-28 |
hydantoin
VLA-UNK-83c3754c-1
0.698
VLA-UNK-70dd90ef-4
0.698
MAT-POS-11ebe265-1
0.543
VLA-UNK-3a43cd95-2
0.520
MAT-POS-8293a91a-8
0.520
VLA-UCB-29506327-1
0.510
VLA-UNK-cf7facf1-1
0.510
VLA-UCB-34f3ed0c-11
0.510
VLA-UNK-c65c1026-5
0.500
VLA-UNK-c65c1026-6
0.429
VLA-UNK-ba665ac8-1
0.417
VLA-UNK-3a43cd95-1
0.411
VLA-UNK-83c3754c-2
0.410
VLA-UNK-c65c1026-2
0.402
MAT-POS-a5ef2d74-2
0.402
EDJ-MED-611d11e7-4
0.402
MAT-POS-ec6d90b7-4
0.402
MAT-POS-90505e2b-1
0.393
MAT-POS-ec6d90b7-1
0.393
MAT-POS-ec6d90b7-2
0.393
VLA-UNK-70dd90ef-1
0.390
VLA-MRT-a639d434-2
0.384
VLA-MRT-8c78ee15-4
0.384
VLA-MRT-a639d434-3
0.383
VLA-MRT-8c78ee15-2
0.383
VLA-MRT-8c78ee15-1
0.383
VLA-UCB-05e51b3f-6
0.378
VLA-UCB-50c39ae8-3
0.378
VLA-UCB-34f3ed0c-12
0.378
PET-UNK-bcc8fd08-2
0.378
VLA-MRT-8c78ee15-3
0.374
MAT-POS-ddfe83c6-4
0.374
VLA-MRT-a639d434-1
0.374
VLA-UNK-56836b69-2
0.374
JAG-UCB-f37eaa14-3
0.374
PET-UNK-49566573-3
0.373
PET-UNK-49566573-4
0.372
MIK-ENA-610c7cf9-1
0.370
MAT-POS-b4d6b7fc-5
0.370
LUO-POS-b4dec3be-1
0.370
MIK-ENA-4bb8c98f-1
0.370
LUO-POS-b4dec3be-2
0.370
BEN-BAS-c2bc0d80-6
0.364
MAT-POS-94643566-1
0.364
VLA-UCB-05e51b3f-5
0.364
VLA-UCB-50c39ae8-2
0.364
VLA-UCB-34f3ed0c-15
0.364
PET-UNK-407a74a5-15
0.364
VLA-UNK-c65c1026-1
0.364
EDG-MED-b1ef7fe3-2
0.361
EDJ-MED-b6c6ee2b-6
0.361
PET-UNK-b78139fa-16
0.361
JOH-MSK-4bb3d434-3
0.359
VLA-UNK-70dd90ef-2
0.358
BEN-BAS-c2bc0d80-7
0.357
ALP-POS-ce760d3f-5
0.355
EDG-MED-90036822-72
0.353
VLA-UNK-f702bf1c-7
0.352
EDJ-MED-b6c6ee2b-7
0.350
PET-UNK-407a74a5-5
0.349
VLA-UNK-ba665ac8-2
0.348
EDG-MED-90036822-107
0.347
VLA-UNK-f702bf1c-3
0.347
PET-UNK-4b4f2bb7-6
0.345
ALP-POS-477dc5b7-4
0.342
MAT-POS-983b399a-1
0.342
EDJ-MED-159244ea-1
0.342
BRU-THA-73c97d88-1
0.342
DAR-DIA-ecdbc7dd-13
0.342
ALP-POS-6f6ae286-3
0.342
PET-UNK-5d7c542f-1
0.342
MAR-UCB-6ab2ec87-5
0.340
MAR-UCB-6ab2ec87-3
0.339
VLA-UNK-3a43cd95-4
0.339
VLA-UCB-34f3ed0c-14
0.339
MAT-POS-853c0ffa-21
0.339
VLA-UNK-f702bf1c-6
0.339
VLA-UNK-56836b69-5
0.336
ALF-EVA-82cf4849-3
0.336
ALF-EVA-82cf4849-4
0.336
BEN-BAS-c2bc0d80-3
0.336
DAR-DIA-ecdbc7dd-4
0.336
VLA-UNK-f702bf1c-8
0.333
EDG-MED-971238d3-9
0.333
JAG-UCB-706446eb-3
0.333
EDJ-MED-159244ea-3
0.333
MAT-POS-983b399a-3
0.333
MAT-POS-853c0ffa-13
0.333
MAT-POS-853c0ffa-14
0.331
RAL-THA-e002e396-5
0.331
DAR-DIA-ecdbc7dd-3
0.331
ALP-POS-477dc5b7-5
0.330
MAT-POS-e20a5dfb-1
0.330
MAT-POS-e20a5dfb-2
0.330
PET-UNK-407a74a5-10
0.330
ALP-POS-e0fe77e5-7
0.330
PET-UNK-10c83c8b-1
0.330
MAT-POS-9db1e783-2
0.330
EDG-MED-971238d3-2
0.330
DAR-DIA-0f7b7cd9-9
0.330