| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 30th, 2008 | 19 | No |
Popular Name: 3-(2-imidazol-1-ylethyl)-2-thioxo-1H-quinazolin-4-one 3-(2-imidazol-1-ylethyl)-2-thiox…
| 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) | 0.72 | 8.8 | -13.94 | 1 | 5 | 0 | 56 | 272.333 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.72 | 9.28 | -35.65 | 2 | 5 | 1 | 57 | 273.341 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 8.37 | -36.33 | 0 | 5 | -1 | 53 | 271.325 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 8.86 | -41 | 1 | 5 | 0 | 54 | 272.333 | 3 | ↓ |
