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) | 2.56 | 7.55 | -41.14 | 0 | 5 | -1 | 65 | 295.746 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.56 | 8.02 | -32.56 | 1 | 5 | 0 | 67 | 296.754 | 2 | ↓ |