Molecular Properties | |
SMILES: | O=C(Cc1cccc(Cl)c1)Nc1cccnc1 |
MW: | 246.06 |
Fraction sp3: | 0.08 |
HBA: | 2 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 41.99 |
cLogP: | 2.92 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Enamine REAL: | Z1079621790 |
Enamine Extended REAL: | s_22____57778____3020518 |
Mcule: | MCULE-6287436710 |
Mcule Ultimate: | JXVSAHMJMLDNGG-UHFFFAOYSA-N |
MolPort: | MolPort-037-616-625 |
Activity Data | |
IC50 (µM) - Fluorescence: | 53.717306778232 |
IC50 (µM) - RapidFire: | 99.0 |
Trypsin IC50 (µM): | 99.0 |
Order Status | |
Ordered: | 2020-05-17 |
Synthesis Location: | enamine |
Shipped: | 2020-05-26 |
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