| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2005 | 12 | Yes |
Popular Name: 5-(2-chlorophenyl)-1H-1,2,4-triazole 5-(2-chlorophenyl)-1H-1,2,4-tria…
Find On: PubMed — Wikipedia — Google
CAS Number: 56015-92-0
| 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) | 2.14 | 6.2 | -7.92 | 1 | 3 | 0 | 42 | 179.61 | 1 | ↓ |
| Ref Reference (pH 7) | 2.14 | 6.26 | -9.45 | 1 | 3 | 0 | 42 | 179.61 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 154 - 156 | Enamine Building Blocks |
| MP | 154...156 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | EP0202758A1; EP0202758B1; EP0915875A2 | IBM Patent Data |
