UCSF

ZINC01095911

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 2004 30 Yes

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

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CAS Number: 298217-98-8

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) 2.95 0.77 -19.38 1 8 0 87 428.514 9 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 128 - 129 KeyOrganics

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