In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 4th, 2008 | 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) | 3.81 | 10.27 | -40.79 | 1 | 3 | 1 | 17 | 297.422 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.81 | 8.06 | -5.38 | 0 | 3 | 0 | 16 | 296.414 | 4 | ↓ |