In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2009 | 34 | No |
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) | 4.46 | 10.71 | -14.17 | 1 | 5 | 0 | 67 | 463.618 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.46 | 11.5 | -80.89 | 2 | 5 | 0 | 68 | 464.626 | 5 | ↓ |