In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 15 | 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) | 3.94 | 4.7 | -37.14 | 3 | 2 | 1 | 37 | 338.063 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.94 | 5.46 | -25.6 | 2 | 2 | 0 | 40 | 337.055 | 3 | ↓ |