In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 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) | 0.57 | 2.76 | -51.26 | 3 | 4 | 1 | 57 | 209.269 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.57 | 2.38 | -12.68 | 2 | 4 | 0 | 56 | 208.261 | 4 | ↓ |