| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 22nd, 2008 | 37 | No |
Popular Name: 3-(2,4-dimethoxyphenyl)-6-nitro-2-[[4-(2-pyridyl)piperazin-1-yl]methyl]quinazolin-4-one 3-(2,4-dimethoxyphenyl)-6-nitro-…
| 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) | 3.11 | 13.61 | -118.84 | 2 | 11 | 2 | 121 | 504.547 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.11 | 11.1 | -15.93 | 0 | 11 | 0 | 119 | 502.531 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.11 | 11.42 | -45 | 1 | 11 | 1 | 120 | 503.539 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.11 | 13.3 | -57.35 | 1 | 11 | 1 | 120 | 503.539 | 7 | ↓ |
