In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 19 | 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) | 0.39 | 0.99 | -42.68 | 2 | 6 | -1 | 111 | 273.297 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.39 | 1.44 | -44.05 | 3 | 6 | 0 | 112 | 274.305 | 3 | ↓ |