UCSF

ZINC01392469

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 28 Yes

Popular Name: 4-chloro-N-({5-[(3,4-dichlorobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}methyl)benzenecarboxamide 4-chloro-N-({5-[(3,4-dichloroben…

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CAS Number: 478049-27-3

Other Names:

MFCD02083128

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) 5.01 12.17 -11.54 1 5 0 60 455.798 7 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 172 - 174 KeyOrganics

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