In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 31 | 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) | 2.75 | 12.95 | -27.06 | 2 | 6 | 0 | 94 | 485.378 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.75 | 11.79 | -44.96 | 1 | 6 | -1 | 90 | 484.37 | 5 | ↓ |