In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 34 | 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) | 4.39 | 13.57 | -13.13 | 0 | 6 | 0 | 60 | 477.008 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.39 | 14.49 | -39.96 | 1 | 6 | 1 | 62 | 478.016 | 9 | ↓ |