| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 2nd, 2010 | 13 | No |
Popular Name: 3-(2H-Tetrazol-5-yl)benzaldehyde 3-(2H-Tetrazol-5-yl)benzaldehyde
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 136689-94-6 , 851069-97-1 , 887035-89-4
1-(4-Fluorophenyl)-5-methyl-1,2,3-triazole-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) | 1.13 | 2.6 | -37.66 | 0 | 5 | -1 | 70 | 173.155 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.13 | 2.7 | -10.65 | 1 | 5 | 0 | 72 | 174.163 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.