In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 13 | 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) | -0.35 | -2.28 | -44.13 | 4 | 4 | 1 | 70 | 183.231 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.35 | -2.69 | -8.66 | 3 | 4 | 0 | 68 | 182.223 | 4 | ↓ |