| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2004 | 22 | Yes |
Popular Name: methyl 2-[(3-oxo-1-phenyl-2,3-dihydro-1H-inden-4-yl)sulfanyl]acetate methyl 2-[(3-oxo-1-phenyl-2,3-di…
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CAS Number: 337921-72-9
| 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) | 3.36 | 10.83 | -14.42 | 0 | 3 | 0 | 43 | 312.39 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 92 - 94 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.
