UCSF

ZINC02452150

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2004 26 Yes

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

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CAS Number: 562832-80-8

Other Names:

MFCD04121639

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) 4.23 1.4 -15.95 1 5 0 59 394.834 5 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 217 - 220 KeyOrganics

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