Molecular Properties | |
SMILES: | Cc1ccncc1NC(=O)Cc1cccc(Cl)c1 |
MW: | 260.724 |
Fraction sp3: | 0.14 |
HBA: | 2 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 41.99 |
cLogP: | 3.22462 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
Source | |
Enamine REAL: | Z1129289650 |
Enamine Extended REAL: | s_22____3391102____3020518 |
Mcule: | MCULE-6726698643 |
Mcule Ultimate: | ZROFBWFSOGSOQG-UHFFFAOYSA-N |
MolPort: | MolPort-047-314-768 |
Activity Data | |
IC50 (µM) - Fluorescence: | 24.5811942010513 |
IC50 (µM) - RapidFire: | 13.8951649217851 |
Trypsin IC50 (µM): | 99.0 |
Order Status | |
Ordered: | 2020-03-31 |
Synthesis Location: | enamine |
Shipped: | 2020-04-09 |
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