In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 13 | 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) | 0.59 | 0.08 | -12.21 | 3 | 4 | 0 | 72 | 175.191 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.59 | 0.89 | -24.87 | 4 | 4 | 1 | 73 | 176.199 | 1 | ↓ |