In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 22nd, 2011 | 15 | 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) | 2.78 | 4.94 | -3.3 | 0 | 2 | 0 | 12 | 225.719 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.78 | 7.22 | -32.12 | 1 | 2 | 1 | 14 | 226.727 | 2 | ↓ |