In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2008 | 14 | 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) | 2.80 | 7.05 | -5.83 | 0 | 1 | 0 | 13 | 187.217 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.80 | 7.25 | -30.93 | 1 | 1 | 1 | 14 | 188.225 | 1 | ↓ |