In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2010 | 12 | 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) | 0.55 | 3.53 | -13.68 | 1 | 4 | 0 | 54 | 162.196 | 0 | ↓ |
Mid Mid (pH 6-8) | 0.55 | 3.08 | -46.71 | 0 | 4 | -1 | 53 | 161.188 | 0 | ↓ |