| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2005 | 28 | No |
Popular Name: N-(2,3-dimethylcyclohexyl)-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)-hexanamide N-(2,3-dimethylcyclohexyl)-6-(4-…
| 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) | 4.08 | 11.47 | -16.91 | 2 | 5 | 0 | 67 | 401.576 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.00 | 8.58 | -45.05 | 1 | 5 | -1 | 67 | 400.568 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.81 | 11.16 | -47.33 | 1 | 5 | -1 | 64 | 400.568 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.27 | 10.1 | -39.47 | 3 | 5 | 1 | 72 | 402.584 | 7 | ↓ |
