In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2010 | 17 | 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) | 1.97 | 6.72 | -7.12 | 0 | 4 | 0 | 38 | 229.283 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.97 | 7.18 | -30.48 | 1 | 4 | 1 | 40 | 230.291 | 1 | ↓ |