In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 13 | 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) | 1.12 | 2.49 | -6.12 | 3 | 4 | 0 | 56 | 182.271 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.12 | 2.61 | -24.37 | 4 | 4 | 1 | 57 | 183.279 | 3 | ↓ |