UCSF

ZINC00897304

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2004 29 No

Popular Name: 4-[5-[({4-nitrophenyl}methyl)sulfanyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]pyridine 4-[5-[({4-nitrophenyl}methyl)sul…

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Other Names:

MFCD02226712

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) 4.48 2.25 -12.91 0 7 0 89 403.467 6 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )