In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 13th, 2009 | 28 | 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) | 0.84 | 8.51 | -12.56 | 0 | 7 | 0 | 89 | 394.387 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.84 | 8.94 | -40.6 | 1 | 7 | 1 | 90 | 395.395 | 2 | ↓ |