| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 18th, 2013 | 27 | Yes |
Popular Name: (S)-2-Benzyl-3-((3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl)propanoic acid (S)-2-Benzyl-3-((3R,4R)-4-(3-hyd…
Find On: PubMed — Wikipedia — Google
CAS Number: 156130-41-5
| 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) | 4.36 | 11.47 | -46.5 | 2 | 4 | 0 | 65 | 367.489 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.36 | 9.42 | -58.03 | 1 | 4 | -1 | 64 | 366.481 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.