| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 26th, 2010 | 23 | No |
Popular Name: (3S)-3-[(4S)-4-(3-fluorophenyl)-4H-pyrazol-3-yl]-1-[(2R)-2-methylbutyl]piperidine (3S)-3-[(4S)-4-(3-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) | 4.59 | 11.15 | -38.22 | 1 | 3 | 1 | 29 | 316.444 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.59 | 9.22 | -7.65 | 0 | 3 | 0 | 28 | 315.436 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
