In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 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) | 0.78 | 3.49 | -50.84 | 2 | 5 | -1 | 85 | 245.258 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.63 | 1.75 | -12.5 | 3 | 5 | 0 | 87 | 246.266 | 3 | ↓ |