In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 38 | 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) | 0.51 | 6.12 | -23.53 | 1 | 11 | 0 | 109 | 526.638 | 12 | ↓ |
Mid Mid (pH 6-8) | 0.51 | 8.39 | -68.07 | 2 | 11 | 1 | 110 | 527.646 | 12 | ↓ |