| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 13th, 2013 | 29 | Yes |
Popular Name: (3S,4R)-Methyl 3-(4-chlorobenzoyl)-6-(4-chlorophenyl)-3,4,5-trihydroxy-6-oxohexanoate (3S,4R)-Methyl 3-(4-chlorobenzoy…
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CAS Numbers: 99886-53-0 , [99886-53-0]
(3S,4R)-Methyl3-(4-chlorobenzoyl)-6-(4-chlorophenyl)-3,4,5-trihydroxy-6-oxohexanoate
| 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) | 1.92 | 7.06 | -9.05 | 3 | 7 | 0 | 121 | 441.263 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.