In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 15th, 2008 | 25 | 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) | 6.29 | 13.24 | -8.84 | 1 | 2 | 0 | 29 | 324.427 | 3 | ↓ |
Mid Mid (pH 6-8) | 6.29 | 13.64 | -26.1 | 2 | 2 | 1 | 30 | 325.435 | 3 | ↓ |