| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 18th, 2013 | 30 | Yes |
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CAS Numbers: 170729-79-0 , 171338-27-5 , 171482-05-6 , 200000-59-5 , [171482-05-6]
(2R,3S)-2-((R)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholine
(2R,3S)-2-((R)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholine hydrochloride
(2R,3S)-2-((R)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholinehydrochloride
2-(R)-[1-(S)-(3,5-Bis(trifluoromethyl)phenyl)ethoxy]-3-(S)-fluorophenylmorpholine
| 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) | 5.32 | 9.45 | -6.13 | 1 | 3 | 0 | 30 | 437.355 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.32 | 10.78 | -50.73 | 2 | 3 | 1 | 35 | 438.363 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.