| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2008 | 11 | Yes |
Popular Name: 2-(2-methyl-1H-imidazol-1-yl)propanoic acid 2-(2-methyl-1H-imidazol-1-yl)pro…
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CAS Numbers: 1214028-80-4 , 782414-84-0
1H-imidazole-1-acetic acid, alpha,2-dimethyl-
1H-Imidazole-1-acetic acid, alpha,2-dimethyl- (9CI)
None
| 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) | -0.31 | 4.13 | -43.63 | 0 | 4 | -1 | 58 | 153.161 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.31 | 4.59 | -41.42 | 1 | 4 | 0 | 59 | 154.169 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 197 - 199 | Enamine Building Blocks |
| MP | 197...199 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.