In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 31st, 2008 | 11 | 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) | 0.79 | 4.53 | -7.43 | 0 | 2 | 0 | 30 | 147.177 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.79 | 4.81 | -39.91 | 1 | 2 | 1 | 31 | 148.185 | 2 | ↓ |