Molecular Properties | |
SMILES: | Cc1ccncc1NC(=O)Nc1cccc(C#N)c1 |
MW: | 252.277 |
Fraction sp3: | 0.07 |
HBA: | 3 |
HBD: | 2 |
Rotatable Bonds: | 2 |
TPSA: | 77.81 |
cLogP: | 2.9057 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Source | |
MolPort: | MolPort-047-314-817 |
Activity Data | |
IC50 (µM) - Fluorescence: | 99.01 |
IC50 (µM) - RapidFire: | 49.3292130545732 |
Trypsin IC50 (µM): | 99.0 |
Order Status | |
Ordered: | 2020-03-31 |
Synthesis Location: | enamine |
Shipped: | 2020-04-17 |
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