Molecular Properties | |
SMILES: | O=C1N[C@@]2(CCOc3ccc(Cl)cc32)C(=O)N1c1cncc2ccccc12 |
MW: | 379.07 |
Fraction sp3: | 0.15 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 1 |
TPSA: | 71.53 |
cLogP: | 3.62 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 0.691612738385489 |
IC50 (µM) - RapidFire: | 0.648697652255834 |
Order Status | |
Ordered: | 2021-01-12 |
Synthesis Location: | enamine |
Shipped: | 2021-01-28 |
hydantoin
VLA-UCB-34f3ed0c-11
VLA-UNK-cf7facf1-1
1.000
VLA-UCB-29506327-1
1.000
VLA-UNK-83c3754c-1
0.738
VLA-UNK-70dd90ef-4
0.738
VLA-UNK-3a43cd95-1
0.716
VLA-UNK-56836b69-2
0.709
VLA-UNK-ba665ac8-1
0.700
VLA-UCB-34f3ed0c-12
0.628
MAT-POS-ec6d90b7-2
0.620
MAT-POS-90505e2b-1
0.620
MAT-POS-ec6d90b7-1
0.620
VLA-UCB-50c39ae8-3
0.611
VLA-UCB-05e51b3f-6
0.611
BEN-BAS-c2bc0d80-6
0.596
VLA-UCB-05e51b3f-5
0.596
VLA-UCB-50c39ae8-2
0.596
MAT-POS-94643566-1
0.596
VLA-UNK-c65c1026-5
0.596
BEN-BAS-c2bc0d80-7
0.583
VLA-UNK-ba665ac8-2
0.582
VLA-UNK-70dd90ef-1
0.570
VLA-UNK-3a43cd95-2
0.568
EDJ-MED-159244ea-1
0.568
MAT-POS-983b399a-1
0.568
ALP-POS-477dc5b7-4
0.568
VLA-UNK-c65c1026-6
0.562
VLA-MRT-8c78ee15-1
0.558
VLA-MRT-a639d434-3
0.558
VLA-MRT-8c78ee15-2
0.558
BEN-BAS-c2bc0d80-3
0.557
VLA-UCB-34f3ed0c-15
0.557
BRU-THA-73c97d88-1
0.552
VLA-UNK-c65c1026-2
0.546
VLA-UNK-f702bf1c-7
0.542
VLA-UNK-83c3754c-2
0.542
EDJ-MED-159244ea-3
0.542
MAT-POS-983b399a-3
0.542
DAR-DIA-0f7b7cd9-9
0.536
VLA-UNK-f702bf1c-3
0.532
VLA-UNK-70dd90ef-2
0.532
DAR-DIA-0f7b7cd9-8
0.531
MAT-POS-e20a5dfb-1
0.530
MAT-POS-e20a5dfb-2
0.530
ALP-POS-e0fe77e5-7
0.530
ALP-POS-477dc5b7-5
0.530
VLA-UNK-f702bf1c-2
0.523
VLA-UCB-34f3ed0c-14
0.523
VLA-UNK-f702bf1c-6
0.523
VLA-MRT-a639d434-2
0.520
VLA-MRT-8c78ee15-4
0.520
VLA-MRT-8c78ee15-3
0.519
VLA-MRT-a639d434-1
0.519
MAT-POS-ddfe83c6-4
0.519
VLA-UCB-34f3ed0c-18
0.518
JAG-UCB-f37eaa14-3
0.515
JOH-MSK-4bb3d434-3
0.514
VLA-UNK-f702bf1c-1
0.514
VLA-UNK-f702bf1c-8
0.514
MAT-POS-61f37a1a-14
0.510
VLA-UNK-f702bf1c-4
0.509
ADA-UCB-dc2b944c-1
0.504
VLA-UNK-56836b69-5
0.500
MAT-POS-983b399a-2
0.500
EDJ-MED-159244ea-2
0.500
VLA-UNK-f702bf1c-5
0.496
VLA-UCB-34f3ed0c-16
0.491
VLA-UCB-34f3ed0c-17
0.491
VLA-UNK-c65c1026-1
0.485
MAT-POS-45b13633-1
0.485
EDG-MED-971238d3-5
0.485
MAT-POS-2bb0cf2b-1
0.485
MAT-POS-e6dd326d-1
0.485
MIK-ENA-f156d06e-1
0.482
MAT-POS-c2d406ed-1
0.482
VLA-UNK-c65c1026-4
0.475
ADA-UCB-b1b30a00-4
0.474
MAT-POS-2905de8c-3
0.465
VLA-UNK-3a43cd95-3
0.462
EDG-MED-971238d3-6
0.462
EDG-MED-971238d3-9
0.462
JAG-UCB-706446eb-3
0.462
YVE-CNR-7d92d73e-1
0.461
MAT-POS-9db1e783-2
0.461
EDG-MED-971238d3-2
0.461
DAR-DIA-ecdbc7dd-13
0.457
VLA-UNK-c65c1026-3
0.456
MAT-POS-3b97339c-2
0.455
EDG-MED-971238d3-4
0.455
MAT-POS-2905de8c-1
0.455
PET-UNK-407a74a5-5
0.455
EDG-MED-971238d3-11
0.455
MAT-POS-e6dd326d-2
0.452
MAT-POS-45b13633-2
0.452
EDJ-MED-e4b030d8-13
0.450
DAR-DIA-6a508060-10
0.450
EDG-MED-971238d3-1
0.450
MAT-POS-8e4737f4-1
0.450
MAT-POS-9db1e783-1
0.450
BEN-DND-a7517465-4
0.450
EDG-MED-971238d3-7
0.449