UCSF

ZINC06093344

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 5th, 2006 12 Yes

Popular Name: 3-(4-Chlorophenyl)-1H-1,2,4-triazole 3-(4-Chlorophenyl)-1H-1,2,4-tria…

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Other Names:

LS-155893

Download: MOL2 SDF SMILES Flexibase

Physical Representations

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) 2.19 5.89 -7.81 1 3 0 42 179.61 1 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID WO1996026200A1; WO2000034247A2 IBM Patent Data

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