| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 25 | Yes |
Popular Name: 2-(4-fluorophenyl)-N-[(1S)-3-methyl-1-(4-methylpiperazine-1-carbonyl)butyl]acetamide 2-(4-fluorophenyl)-N-[(1S)-3-met…
| 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) | 2.27 | 5.93 | -8.54 | 1 | 5 | 0 | 53 | 349.45 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.27 | 8.28 | -47.67 | 2 | 5 | 1 | 54 | 350.458 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
