In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2007 | 20 | No |
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) | 1.72 | 1.72 | -13.05 | 0 | 5 | 0 | 57 | 273.288 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.72 | 1.83 | -37.68 | 1 | 5 | 1 | 58 | 274.296 | 6 | ↓ |