In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 16 | 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) | 2.12 | 6.65 | -46.08 | 0 | 4 | -1 | 59 | 231.312 | 12 | ↓ |
Lo Low (pH 4.5-6) | 2.12 | 4.67 | -8.92 | 1 | 4 | 0 | 56 | 232.32 | 12 | ↓ |