| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 20 | No |
Popular Name: 3-[(1S,2R,4S)-2,4-dimethylcyclohexyl]-2-sulfanyl-quinazolin-4-one 3-[(1S,2R,4S)-2,4-dimethylcycloh…
| 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) | 3.19 | 9.6 | -8.83 | 1 | 3 | 0 | 38 | 288.416 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.92 | 9.15 | -40.66 | 0 | 3 | -1 | 35 | 287.408 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
