| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2011 | 23 | Yes |
Popular Name: 2-(dimethylamino)-1-[4-(5-fluoroquinazolin-4-yl)piperazin-1-yl]ethanone 2-(dimethylamino)-1-[4-(5-fluoro…
| 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) | 1.12 | 9 | -42.63 | 1 | 6 | 1 | 54 | 318.376 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.12 | 6.61 | -11.37 | 0 | 6 | 0 | 53 | 317.368 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.12 | 9.47 | -81.49 | 2 | 6 | 2 | 55 | 319.384 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
