| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 21 | Yes |
Popular Name: 7-chloro-2-[[4-(dimethylamino)butylamino]methyl]-3H-quinazolin-4-one 7-chloro-2-[[4-(dimethylamino)bu…
| 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) | 1.87 | 5.44 | -47.22 | 3 | 5 | 1 | 62 | 309.821 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 3.38 | -59.85 | 2 | 5 | 0 | 65 | 308.813 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.87 | 6.82 | -113.27 | 4 | 5 | 2 | 67 | 310.829 | 7 | ↓ |
