In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 30th, 2010 | 34 | No |
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) | 2.87 | 8.89 | -46.95 | 3 | 7 | 1 | 105 | 474.618 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.87 | 6.97 | -17.35 | 2 | 7 | 0 | 104 | 473.61 | 8 | ↓ |