UCSF

ZINC02325811

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 26 Yes

Popular Name: N-(3,4-difluorophenyl)-2-{[4-methyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide N-(3,4-difluorophenyl)-2-{[4-met…

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CAS Number: 847918-01-8

Other Names:

MFCD04121622

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) 3.98 1.87 -16.85 1 5 0 59 374.416 5 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 189 - 190 KeyOrganics

Activity (Go SEA)

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