| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2004 | 27 | Yes |
Popular Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-(4-propoxyphenyl)quinazoline 4-(4-methylpiperazin-4-ium-1-yl)…
| 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) | 4.71 | 12.56 | -44.57 | 1 | 5 | 1 | 43 | 363.485 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.71 | 10.19 | -8.4 | 0 | 5 | 0 | 41 | 362.477 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.71 | 12.9 | -81.58 | 2 | 5 | 2 | 44 | 364.493 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.71 | 10.53 | -25.11 | 1 | 5 | 1 | 43 | 363.485 | 5 | ↓ |
