In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 31st, 2006 | 40 | 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) | 7.08 | 15.53 | -13.3 | 1 | 7 | 0 | 80 | 559.732 | 13 | ↓ |
Mid Mid (pH 6-8) | 7.08 | 14.91 | -13.01 | 1 | 7 | 0 | 80 | 559.732 | 13 | ↓ |