| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 16 | No |
Popular Name: Tinidazole Tinidazole
Find On: PubMed — Wikipedia — Google
CAS Numbers: 19387-91-8 , [19387-91-8]
1-(2-(ethylsulfonyl)ethyl)-2-methyl-5-nitro-1H-imidazole
1-(2-Ethanesulfonyl-ethyl)-2-methyl-5-nitro-1H-imidazole
1-(ethylsulfonyl)-2-(2-methyl-5-nitroimidazolyl)ethane
1-[2-(ethanesulfonyl)ethyl]-2-methyl-5-nitro-1H-imidazole
1-[2-(Ethylsulfonyl)ethyl]-2-methyl-5-nitro-
1-[2-(ethylsulfonyl)ethyl]-2-methyl-5-nitro-1H-imidazole
19387-91-8; Prestwick_136; Tinidazole
| 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) | -0.06 | 4.42 | -15.75 | 0 | 7 | 0 | 98 | 247.276 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mechanism | . | ZereneX Building Blocks |
| Melting Pt.: | 118-120?C | Toronto Research Chemicals |
| ALOGPS_SOLUBILITY | 3.03e+00 g/l | DrugBank-approved |
| purity | 9.500000000000000e+001 | Enamine Building Blocks |
| Indications | antiparasitic | KeyOrganics Bioactives |
| Therapy | antiprotozoal | SMDC Iconix |
| biological_use | Antitrichomonal, antimicrobial agent | IBScreen Bioactives IBScreen Bioactives |
| Solubility: | Chloroform, Methanol | Toronto Research Chemicals |
| PUBCHEM_SUBSTANCE_COMMENT | NCC_SAMPLE_SUPPLIER : Sigma Chemical Company; NCC_SUPPLIER_STRUCTURE_ID : T3021 | NIH Clinical Collection via PubChem |
| biological_use | Protozoacide | IBScreen Bioactives |
| mechanism | The free nitro radical generated as a result of this reduction may be responsible for the antiprotozoal activity | IBScreen Bioactives |
| mechanism | The nitro group of tinidazole is reduced by cell extracts of Trichomonas. | IBScreen Bioactives |
