| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 17 | Yes |
Popular Name: [(5-methyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio]acetic acid [(5-methyl-4-phenyl-4H-1,2,4-tri…
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CAS Numbers: , 200815-83-4 , [200815-83-4]
(5-Methyl-4-phenyl-4 H -[1,2,4]triazol-3-ylsulfany
(5-Methyl-4-phenyl-4 H -[1,2,4]triazol-3-ylsulfanyl)-acetic acid
(5-Methyl-4-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid
(5-Methyl-4-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-aceticacid
2-[(5-methyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetic acid
acetic acid, [(5-methyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio]-
[(5-methyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetic acid
| 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) | 0.99 | 7.87 | -50.68 | 0 | 5 | -1 | 71 | 248.287 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
