| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 12 | Yes |
Popular Name: 3-(2H-1,2,3-triazol-4-yl)aniline 3-(2H-1,2,3-triazol-4-yl)aniline
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1461706-10-4 , 876343-39-4
| 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) | 0.51 | 1 | -6.78 | 3 | 4 | 0 | 68 | 160.18 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | US4141917 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.
