| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 19 | No |
Popular Name: 3-[(1S,3R)-3-methylcyclohexyl]-2-sulfanyl-quinazolin-4-one 3-[(1S,3R)-3-methylcyclohexyl]-2…
| 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) | 2.95 | 9.12 | -9.94 | 1 | 3 | 0 | 38 | 274.389 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.68 | 8.85 | -41.03 | 0 | 3 | -1 | 35 | 273.381 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
