In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 31st, 2008 | 27 | Yes |
Popular Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)acetamide 2-[(3-cyano-5,6,7,8-tetrahydroqu…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.58 | 7.58 | -15.68 | 1 | 6 | 0 | 84 | 383.473 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.58 | 7.79 | -46.76 | 2 | 6 | 1 | 85 | 384.481 | 6 | ↓ |