Molecule Details
| Molecular Properties | |
| SMILES: | CN1CCc2ccc(Cl)cc2C1C(=O)Nc1cncc2ccccc12 |
| MW: | 351.11 |
| Fraction sp3: | 0.2 |
| HBA: | 3 |
| HBD: | 1 |
| Rotatable Bonds: | 2 |
| TPSA: | 45.23 |
| cLogP: | 4.06 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
| Activity Data | |
| IC50 (µM) - Fluorescence: | 3.00283699538179 |
| Order Status | |
| Ordered: | 2021-02-14 |
| Synthesis Location: | enamine |
| Shipped: | 2021-03-17 |
EDJ-MED-2791eece-2
0.718
EDJ-MED-b774e9fe-1
0.718
EDJ-MED-2791eece-6
0.709
EDJ-MED-b774e9fe-2
0.709
EDJ-MED-2791eece-12
0.701
EDJ-MED-036ae2e9-2
0.693
EDJ-MED-2791eece-3
0.692
EDJ-MED-036ae2e9-1
0.690
EDJ-MED-2791eece-8
0.685
EDJ-MED-b774e9fe-3
0.685
EDJ-MED-036ae2e9-3
0.685
EDJ-MED-2791eece-11
0.678
EDJ-MED-2791eece-5
0.670
EDJ-MED-2791eece-10
0.667
MAT-POS-fb82b63d-4
0.667
EDJ-MED-2791eece-1
0.667
EDJ-MED-036ae2e9-8
0.663
EDJ-MED-487c5e9f-4
0.663
EDJ-MED-036ae2e9-4
0.660
EDJ-MED-2791eece-7
0.656
EDJ-MED-487c5e9f-10
0.653
EDJ-MED-036ae2e9-11
0.646
EDJ-MED-2791eece-4
0.645
EDJ-MED-036ae2e9-9
0.645
EDJ-MED-036ae2e9-10
0.645
EDJ-MED-487c5e9f-9
0.645
EDJ-MED-036ae2e9-7
0.638
EDJ-MED-036ae2e9-6
0.632
EDJ-MED-2791eece-9
0.622
EDJ-MED-487c5e9f-8
0.622
ALP-POS-d054b76b-2
0.622
EDJ-MED-487c5e9f-7
0.619
EDJ-MED-036ae2e9-5
0.616
EDJ-MED-487c5e9f-11
0.612
EDJ-MED-487c5e9f-2
0.610
EDJ-MED-036ae2e9-12
0.606
EDJ-MED-487c5e9f-5
0.606
EDJ-MED-487c5e9f-6
0.606
EDJ-MED-487c5e9f-1
0.606
EDJ-MED-487c5e9f-3
0.604
DAR-DIA-4987d2cd-3
0.583
MAT-POS-fb82b63d-1
0.578
MIC-UNK-91acba05-4
0.578
ALP-POS-477dc5b7-1
0.578
DAR-DIA-4987d2cd-4
0.573
EDJ-MED-487c5e9f-12
0.561
MAT-POS-dd3ad2b5-1
0.559
BEN-DND-f2e727cd-6
0.559
MAT-POS-24589f88-3
0.547
MAT-POS-dd3ad2b5-4
0.547
MAT-POS-24589f88-2
0.547
MAR-UCB-6ab2ec87-6
0.543
ALP-POS-d054b76b-4
0.539
MAT-POS-4223bc15-18
0.536
RAL-THA-8416115c-2
0.532
MIC-UNK-91acba05-6
0.532
EDG-MED-5d232de5-5
0.532
EDG-MED-5d232de5-6
0.532
PET-UNK-9b23ef84-2
0.531
MAT-POS-4223bc15-19
0.531
MAT-POS-dd3ad2b5-2
0.531
RAL-THA-6e4c80cf-1
0.531
MAT-POS-4223bc15-1
0.531
MAT-POS-4223bc15-6
0.531
ALP-UNI-c3ef0aba-2
0.527
BEN-DND-f2e727cd-4
0.527
MAT-POS-d8472c4f-5
0.527
BEN-DND-f2e727cd-5
0.527
MAT-POS-3ccb8ef6-1
0.527
MAT-POS-3ccb8ef6-2
0.527
MIC-UNK-45817b9b-2
0.526
MAT-POS-8293a91a-4
0.525
MAT-POS-4223bc15-23
0.525
PET-UNK-d61f3ea6-2
0.525
MAT-POS-4223bc15-2
0.525
MAT-POS-8293a91a-5
0.525
MAT-POS-4223bc15-28
0.525
BEN-BAS-c2bc0d80-1
0.522
MAR-UCB-6ab2ec87-7
0.521
RAL-THA-8416115c-4
0.520
BRU-THA-98e973b9-1
0.520
MAT-POS-4223bc15-13
0.520
BEN-DND-32596b04-2
0.519
EDJ-MED-1981ceba-5
0.519
DAR-DIA-0f2f46c9-12
0.516
MIC-UNK-91acba05-2
0.516
EDJ-MED-eb111c00-1
0.516
PET-UNK-1b92fa34-1
0.516
RAL-THA-4aa06b95-6
0.515
MAT-POS-dd3ad2b5-3
0.515
MAT-POS-dd3ad2b5-5
0.515
MAT-POS-4223bc15-3
0.515
CLI-TLC-3a13eaf2-1
0.515
BEN-DND-32596b04-7
0.515
RAL-THA-4aa06b95-7
0.515
MAT-POS-4223bc15-24
0.515
EDJ-MED-1981ceba-2
0.515
PET-UNK-af70882d-3
0.515
MAT-POS-4223bc15-40
0.514
MAT-POS-78e1d523-1
0.511