Molecular Properties | |
SMILES: | O=C1CC2(CCOc3ccc(Cl)cc32)C(=O)N1c1cncc2ccccc12 |
MW: | 378.08 |
Fraction sp3: | 0.19 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 1 |
TPSA: | 59.5 |
cLogP: | 3.87 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 0.485865063914067 |
Order Status | |
Shipped: | 2021-02-11 |
phthalimide
VLA-UCB-1dbca3b4-15
MAT-POS-94643566-1
1.000
VLA-UCB-50c39ae8-2
1.000
VLA-UCB-05e51b3f-5
1.000
VLA-UCB-05e51b3f-6
0.742
VLA-UCB-50c39ae8-3
0.742
VLA-UNK-3a43cd95-3
0.730
VLA-UCB-34f3ed0c-12
0.685
VLA-UNK-c65c1026-2
0.652
EDJ-MED-159244ea-1
0.641
MAT-POS-983b399a-1
0.641
ALP-POS-477dc5b7-4
0.641
VLA-UNK-ba665ac8-2
0.619
VLA-UNK-ba665ac8-1
0.615
BEN-BAS-c2bc0d80-3
0.611
MAT-POS-e20a5dfb-1
0.598
MAT-POS-e20a5dfb-2
0.598
ALP-POS-e0fe77e5-7
0.598
ALP-POS-477dc5b7-5
0.598
VLA-UNK-cf7facf1-1
0.596
VLA-UCB-34f3ed0c-11
0.596
VLA-UCB-29506327-1
0.596
MAT-POS-90505e2b-1
0.589
MAT-POS-ec6d90b7-1
0.589
MAT-POS-ec6d90b7-2
0.589
EDJ-MED-159244ea-3
0.579
MAT-POS-983b399a-3
0.579
BEN-BAS-c2bc0d80-7
0.571
VLA-UCB-53bdeed6-5
0.568
VLA-UNK-c65c1026-6
0.567
VLA-UNK-3a43cd95-4
0.567
JAG-UCB-f37eaa14-3
0.552
VLA-UNK-c65c1026-5
0.551
JOH-MSK-1f2dff76-3
0.541
JOH-MSK-1f2dff76-4
0.541
BRU-THA-73c97d88-1
0.541
JOH-MSK-51c67e7d-2
0.541
JOH-MSK-51c67e7d-1
0.541
ADA-UCB-dc2b944c-1
0.536
VLA-UNK-83c3754c-1
0.526
VLA-UNK-70dd90ef-4
0.526
DAR-DIA-0f7b7cd9-9
0.525
VLA-UCB-34f3ed0c-17
0.522
VLA-UCB-34f3ed0c-18
0.522
VLA-UNK-c65c1026-1
0.520
DAR-DIA-0f7b7cd9-8
0.520
VLA-UNK-83c3754c-2
0.515
PET-UNK-626a1084-1
0.514
PET-UNK-626a1084-2
0.514
PET-UNK-626a1084-3
0.514
PET-UNK-626a1084-4
0.514
VLA-UNK-f702bf1c-4
0.513
PET-UNK-77d5678a-2
0.509
12_-111-3e02a1cd-1
0.509
PET-UNK-77d5678a-5
0.509
VLA-UCB-34f3ed0c-16
0.509
EDJ-MED-159244ea-2
0.505
MAT-POS-983b399a-2
0.505
JOH-MSK-4bb3d434-2
0.505
PET-UNK-77d5678a-6
0.505
12_-111-3e02a1cd-2
0.505
PET-UNK-77d5678a-3
0.505
VLA-UNK-f702bf1c-7
0.505
VLA-UCB-34f3ed0c-15
0.505
VLA-UNK-f702bf1c-5
0.500
VLA-UCB-34f3ed0c-14
0.500
VLA-UCB-53bdeed6-6
0.500
VLA-UNK-f702bf1c-2
0.500
VLA-UNK-f702bf1c-6
0.500
VLA-UNK-f702bf1c-3
0.496
MAT-POS-1bed62cf-2
0.495
LUO-POS-868e8996-7
0.495
LUO-POS-868e8996-8
0.495
PET-UNK-94036022-5
0.495
PET-UNK-94036022-12
0.495
JOH-MSK-1f2dff76-1
0.495
JOH-MSK-1f2dff76-2
0.495
MAT-POS-1bed62cf-3
0.495
VLA-UNK-f702bf1c-8
0.491
VLA-UNK-f702bf1c-1
0.491
MAT-POS-1bed62cf-1
0.491
LUO-POS-868e8996-9
0.491
LUO-POS-868e8996-10
0.491
PET-UNK-6af7266d-2
0.491
PET-UNK-6af7266d-4
0.491
NIR-THE-1e03c142-1
0.490
VLA-UNK-c65c1026-3
0.490
PET-UNK-94036022-11
0.486
PET-UNK-94036022-4
0.486
VLA-UNK-70dd90ef-3
0.480
VLA-UCB-53bdeed6-4
0.480
PET-UNK-77d5678a-1
0.473
PET-UNK-77d5678a-4
0.473
EDG-MED-971238d3-5
0.462
MAT-POS-2bb0cf2b-1
0.462
MAT-POS-e6dd326d-1
0.462
MAT-POS-45b13633-1
0.462
VLA-UNK-3a43cd95-1
0.457
VLA-UNK-c65c1026-4
0.451
ALP-POS-e0fe77e5-8
0.449
VLA-UNK-56836b69-2
0.447