| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 27 | Yes |
Popular Name: 2-[(4-ethylpiperazin-1-yl)methyl]-3-(4-fluorophenyl)quinazolin-4-one 2-[(4-ethylpiperazin-1-yl)methyl…
| 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) | 2.67 | 10.75 | -42.88 | 1 | 5 | 1 | 43 | 367.448 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.67 | 10.71 | -42.77 | 1 | 5 | 1 | 43 | 367.448 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.67 | 8.44 | -8.81 | 0 | 5 | 0 | 41 | 366.44 | 4 | ↓ |
