| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 25 | Yes |
Popular Name: (1S)-2-[4-[(2S)-2-(3-fluorophenyl)-2-hydroxy-ethyl]piperazin-1-yl]-1-phenyl-ethanol (1S)-2-[4-[(2S)-2-(3-fluoropheny…
| 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) | 2.00 | 2.72 | -7.76 | 2 | 4 | 0 | 47 | 344.43 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.00 | 5.06 | -43.4 | 3 | 4 | 1 | 48 | 345.438 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.00 | 4.96 | -41.48 | 3 | 4 | 1 | 48 | 345.438 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
