Molecular Properties | |
SMILES: | O=C(Nc1cnccc1CO)[C@@H]1COc2ccc(Cl)cc21 |
MW: | 304.06 |
Fraction sp3: | 0.2 |
HBA: | 4 |
HBD: | 2 |
Rotatable Bonds: | 3 |
TPSA: | 71.45 |
cLogP: | 2.34 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Mcule: | MCULE-7524608913 |
Activity Data | |
IC50 (µM) - Fluorescence: | 42.3593491560688 |
IC50 (µM) - RapidFire: | 18.387963478411 |
Trypsin IC50 (µM): | 99.0 |
Order Status | |
Ordered: | 2020-05-17 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
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