| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 30th, 2011 | 54 | No |
1009119-65-6; D10105; Daclatasvir dihydrochloride (USAN)
| 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) | 7.77 | 11.95 | -24.08 | 4 | 14 | 0 | 175 | 738.89 | 13 | ↓ |
| Lo Low (pH 4.5-6) | 7.77 | 12.38 | -49.7 | 5 | 14 | 1 | 176 | 739.898 | 13 | ↓ |
| Lo Low (pH 4.5-6) | 7.77 | 12.83 | -81.8 | 6 | 14 | 2 | 177 | 740.906 | 13 | ↓ |
No pre-computed analogs available. Try a structural similarity search.