| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2005 | 8 | Yes |
Popular Name: 1,3-Thiazole-4-carboxylic acid 1,3-Thiazole-4-carboxylic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 08/08/73 , 1235440-96-6 , 3973-07-7 , 3973-08-8 , 3973/8/8 , [3973-07-7] , [3973-08-8]
1,3-thiazole-4-carboxylic acid hyrobromide
sodium 1,3-thiazole-4-carboxylate
Thiazole-4-carboxylic acid hydrobromide
| 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) | 0.68 | 1.99 | -54.12 | 0 | 3 | -1 | 53 | 128.132 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 195 - 197 | Enamine Building Blocks |
| MP | 195...197 | Enamine Building Blocks |
| MP | 197-199° | Matrix Scientific |
| MP | 197-199° (dec.) | Fluorochem |
| MP | 229-232° | Matrix Scientific |
| MP | 297 - 299 | Enamine Building Blocks |
| MP | 297...299 | Enamine Building Blocks |
| ALOGPS_SOLUBILITY | 3.39e+00 g/l | DrugBank-experimental |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 98% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.