In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2004 | 11 | Yes |
Popular Name: 4-(4H-1,2,4-triazol-3-yl)pyridine 4-(4H-1,2,4-triazol-3-yl)pyridine
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CAS Number: 14803-99-7
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) | 0.22 | 3.58 | -9.51 | 1 | 4 | 0 | 54 | 146.153 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 225 - 227 | Enamine Building Blocks |
MP | 225...227 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
PUBCHEM_PATENT_ID | EP0122693A1; EP0441718A1; US4625036; US5252573 | IBM Patent Data |