| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 9th, 2009 | 29 | Yes |
Popular Name: 4-methyl-2-[2-oxo-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethoxy]benzamide 4-methyl-2-[2-oxo-2-[4-(2-phenox…
| 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) | 2.66 | 6.82 | -26.47 | 2 | 7 | 0 | 85 | 397.475 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.66 | 9.15 | -62.79 | 3 | 7 | 1 | 86 | 398.483 | 8 | ↓ |
Popular Name: 2-[2-(aminomethyl)-4-methoxy-phenoxy]-1-(4-methylpiperazin-1-yl)ethanone 2-[2-(aminomethyl)-4-methoxy-phe…
| 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) | 0.41 | 2.2 | -42.19 | 3 | 6 | 1 | 70 | 294.375 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.41 | 1.78 | -13.14 | 2 | 6 | 0 | 68 | 293.367 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.41 | 4.55 | -94.12 | 4 | 6 | 2 | 71 | 295.383 | 5 | ↓ |
