In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2010 | 25 | Yes |
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) | 5.50 | 12.39 | -9.89 | 0 | 3 | 0 | 27 | 348.833 | 5 | ↓ |
Lo Low (pH 4.5-6) | 5.50 | 13.11 | -32.39 | 1 | 3 | 1 | 28 | 349.841 | 5 | ↓ |