| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 30th, 2014 | 28 | No |
Popular Name: 1-((1S,2S)-1-Hydroxy-1-(4-hydroxyphenyl)propan-2-yl)-4-phenylpiperidin-4-ol methanesulfonate 1-((1S,2S)-1-Hydroxy-1-(4-hydrox…
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CAS Numbers: 188591-67-5 , 189894-57-3
| 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) | 2.42 | 3.98 | -45.96 | 3 | 6 | 1 | 88 | 406.524 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.42 | 2.26 | -13.36 | 2 | 6 | 0 | 87 | 405.516 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.