In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 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) | 3.05 | 6.33 | -39.8 | 2 | 3 | 1 | 29 | 269.453 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.05 | 8.68 | -103.71 | 3 | 3 | 2 | 30 | 270.461 | 7 | ↓ |