In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2009 | 25 | 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) | 3.46 | 8.6 | -50.3 | 1 | 5 | -1 | 79 | 349.447 | 11 | ↓ |
Lo Low (pH 4.5-6) | 3.46 | 6.62 | -9.26 | 2 | 5 | 0 | 76 | 350.455 | 11 | ↓ |