In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 17 | 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) | 0.18 | 4.25 | -36.97 | 2 | 5 | 1 | 50 | 235.311 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.18 | 1.78 | -13.38 | 1 | 5 | 0 | 48 | 234.303 | 2 | ↓ |