UCSF

ZINC12952106

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2008 39 No

Popular Name: 4-fluoro-N-(1-{5-[(4-methoxybenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazol-3-yl}-2-phenylethyl)benzenecarboxamide 4-fluoro-N-(1-{5-[(4-methoxybenz…

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CAS Number: 478066-92-1

Other Names:

MFCD01315124

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) 6.15 16.69 -11.45 1 6 0 69 538.648 10 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 167 - 168 KeyOrganics

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