In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 4th, 2006 | 28 | 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) | 4.59 | 11.68 | -13.26 | 1 | 5 | 0 | 56 | 375.403 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.59 | 12.11 | -31.72 | 2 | 5 | 1 | 57 | 376.411 | 4 | ↓ |