In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2009 | 38 | 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) | 5.39 | 12.67 | -14.22 | 0 | 7 | 0 | 60 | 512.585 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.39 | 14.92 | -59.92 | 1 | 7 | 1 | 61 | 513.593 | 5 | ↓ |