In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 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) | 0.68 | 5.81 | -88.5 | 4 | 3 | 2 | 35 | 249.402 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.68 | 3.5 | -45.25 | 3 | 3 | 1 | 34 | 248.394 | 4 | ↓ |