UCSF

ZINC05200179

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 25th, 2006 19 No

Popular Name: 6-[(4-methylphenyl)sulfanyl]imidazo[2,1-b][1,3]thiazole-5-carbaldehyde oxime 6-[(4-methylphenyl)sulfanyl]imid…

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CAS Number: 339022-88-7

Other Names:

MFCD00139168

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) 4.40 6.92 -12.46 1 4 0 50 289.385 3 ↓
Ref Reference (pH 7) 4.40 6.73 -11.53 1 4 0 50 289.385 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 191 - 192 KeyOrganics

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Rings

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

No pre-computed analogs available. Try a structural similarity search.