In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 22 | 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) | 5.06 | 11.49 | -56.96 | 1 | 4 | 0 | 54 | 305.418 | 12 | ↓ |
Mid Mid (pH 6-8) | 5.06 | 9.1 | -60.45 | 0 | 4 | -1 | 53 | 304.41 | 12 | ↓ |