| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 28 | Yes |
Popular Name: (2S)-N-benzyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propanamide (2S)-N-benzyl-2-[4-[3-(trifluoro…
| 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) | 3.64 | 8.2 | -9.3 | 1 | 4 | 0 | 36 | 391.437 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.64 | 10.34 | -41.08 | 2 | 4 | 1 | 37 | 392.445 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
