| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2005 | 12 | Yes |
Popular Name: 3,5-Bis-methylsulfanyl-isothiazole-4-carboxylic acid 3,5-Bis-methylsulfanyl-isothiazo…
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CAS Number: 4886-15-1
3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxylic acid
3,5-bis(methylsulfanyl)-4-isothiazolecarboxylic acid
3,5-bis(methylthio)isothiazole-4-carboxylic acid
3,5-Bis-methylsulfanyl-isothiazole-4-carboxylic ac
3,5-bis-methylsulfanyl-isothiazole-4-carboxylicacid
| 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) | 2.01 | 4.7 | -47.88 | 0 | 3 | -1 | 53 | 220.32 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.