In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 19 | 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) | 2.56 | 7.05 | -33.86 | 2 | 3 | 1 | 26 | 261.389 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.56 | 7.99 | -112.02 | 3 | 3 | 2 | 30 | 262.397 | 5 | ↓ |