In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 31st, 2009 | 21 | 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) | 3.09 | 9.9 | -52.86 | 0 | 5 | -1 | 67 | 281.291 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.09 | 10.38 | -71.48 | 1 | 5 | 0 | 68 | 282.299 | 5 | ↓ |