In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2010 | 13 | 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) | 0.52 | 1.96 | -6.25 | 0 | 3 | 0 | 30 | 183.251 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.52 | 4.39 | -41.68 | 1 | 3 | 1 | 31 | 184.259 | 1 | ↓ |