In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2011 | 22 | 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) | 3.55 | 8.79 | -9.89 | 0 | 3 | 0 | 24 | 296.414 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.55 | 10.86 | -48.78 | 1 | 3 | 1 | 25 | 297.422 | 4 | ↓ |