In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 31st, 2009 | 34 | 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) | -0.95 | 7.25 | -61.33 | 1 | 9 | -1 | 147 | 480.522 | 7 | ↓ |
Lo Low (pH 4.5-6) | -0.95 | 7.66 | -45.83 | 2 | 9 | 0 | 152 | 481.53 | 7 | ↓ |