| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 18 | Yes |
Popular Name: 2-{[(4-fluorophenyl)sulfonyl]amino}-3-methylbutanoic acid 2-{[(4-fluorophenyl)sulfonyl]ami…
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CAS Numbers: 250714-79-5 , [250714-79-5]
2-(4-Fluorobenzenesulfamido)-3-Methylbutyric Acid ; (N-(4-Fluorobenzenesulfonylvaline)
2-(4-Fluorobenzenesulphamido)-3-methylbutyric acid 97%
2-{[(4-Fluorophenyl)sulfonyl]amino}-3-methyl
2-{[(4-Fluorophenyl)sulfonyl]amino}-3-methyl butanoic acid
2-{[(4-fluorophenyl)sulfonyl]amino}-3-methylbutanoicacid
| 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) | 0.07 | -3.14 | -50.91 | 1 | 5 | -1 | 86 | 274.293 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 159 - 161 | KeyOrganics |
| MP | 159-161° | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.