In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 23 | No |
Popular Name: 3-ethoxy-4-[4-(4-methylpiperazin-1-yl)butoxy]benzaldehyde 3-ethoxy-4-[4-(4-methylpiperazin…
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) | 2.21 | 7.61 | -46.61 | 1 | 5 | 1 | 43 | 321.441 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.21 | 5.29 | -11.14 | 0 | 5 | 0 | 42 | 320.433 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.21 | 7.75 | -44.07 | 1 | 5 | 1 | 43 | 321.441 | 9 | ↓ |