In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 19 | 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) | 1.58 | 8.96 | -56.75 | 0 | 6 | -1 | 84 | 261.257 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.58 | 9.44 | -64.27 | 1 | 6 | 0 | 86 | 262.265 | 6 | ↓ |