In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | 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) | 2.92 | 5.16 | -5.57 | 0 | 3 | 0 | 30 | 285.796 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.92 | 7.34 | -36.12 | 1 | 3 | 1 | 31 | 286.804 | 3 | ↓ |