In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 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) | 1.39 | 7.47 | -58.76 | 0 | 5 | -1 | 70 | 280.344 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.39 | 5.05 | -13.7 | 1 | 5 | 0 | 67 | 281.352 | 3 | ↓ |