In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2008 | 17 | 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) | 0.92 | 5.59 | -9.8 | 1 | 6 | 0 | 84 | 230.227 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.92 | 6.02 | -40.64 | 2 | 6 | 1 | 85 | 231.235 | 4 | ↓ |