In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2010 | 34 | 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) | 4.46 | 13.33 | -12.55 | 0 | 7 | 0 | 67 | 475.618 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.46 | 15.53 | -51.27 | 1 | 7 | 1 | 69 | 476.626 | 8 | ↓ |