| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2008 | 23 | Yes |
Popular Name: 3-(4-methylpiperazin-1-yl)-N-[4-(trifluoromethoxy)phenyl]propanamide 3-(4-methylpiperazin-1-yl)-N-[4-…
| 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) | 2.28 | 4.78 | -43.28 | 2 | 5 | 1 | 46 | 332.346 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.28 | 4.65 | -46.79 | 2 | 5 | 1 | 46 | 332.346 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.28 | 2.32 | -9.75 | 1 | 5 | 0 | 45 | 331.338 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
