| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 14 | Yes |
Popular Name: 4-(3-methyl-1H-1,2,4-triazol-5-yl)benzonitrile 4-(3-methyl-1H-1,2,4-triazol-5-y…
Find On: PubMed — Wikipedia — Google
CAS Number: 1152889-67-2
| 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) | 1.35 | 5.58 | -9.31 | 1 | 4 | 0 | 65 | 184.202 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
