In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 20 | 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) | 3.39 | 7.99 | -50.09 | 2 | 4 | -1 | 69 | 269.324 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.39 | 7.84 | -40.11 | 3 | 4 | 0 | 71 | 270.332 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.39 | 8.56 | -51.97 | 3 | 4 | 0 | 71 | 270.332 | 4 | ↓ |