| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2011 | 27 | Yes |
Popular Name: (3S)-1-[(3R)-3-(4-fluorophenyl)-4-methyl-piperazin-1-yl]-3-(4-methoxyphenyl)butan-1-one (3S)-1-[(3R)-3-(4-fluorophenyl)-…
| 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) | 4.23 | 9.36 | -9.21 | 0 | 4 | 0 | 33 | 370.468 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.23 | 11.37 | -50.25 | 1 | 4 | 1 | 34 | 371.476 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
