| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 27 | Yes |
Popular Name: 2-[(4-benzylpiperazin-1-yl)methyl]-6,8-dibromo-3H-quinazolin-4-one 2-[(4-benzylpiperazin-1-yl)methy…
None
| 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) | 3.71 | 9.81 | -48.81 | 2 | 5 | 1 | 53 | 493.223 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.16 | 4.78 | -39.89 | 0 | 5 | -1 | 55 | 491.207 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.71 | 7.58 | -8.12 | 1 | 5 | 0 | 52 | 492.215 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.16 | 7.06 | -37.04 | 1 | 5 | 0 | 57 | 492.215 | 4 | ↓ |
