| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2011 | 15 | Yes |
Popular Name: (3S)-3-[(3-fluorophenyl)methyl]piperazin-2-one (3S)-3-[(3-fluorophenyl)methyl]p…
Find On: PubMed — Wikipedia — Google
CAS Number: 1246548-65-1
| 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) | 1.00 | 1.87 | -8.63 | 2 | 3 | 0 | 41 | 208.236 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.00 | 3.06 | -50.05 | 3 | 3 | 1 | 46 | 209.244 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
