UCSF

ZINC00119911

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 13 No

Popular Name: 2-(4-METHOXYPHENOXY)ETHANETHIOAMIDE 2-(4-METHOXYPHENOXY)ETHANETHIOAMIDE

Find On: PubMed — Wikipedia — Google

CAS Numbers: 35370-92-4 , [35370-92-4]

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) 0.97 2.61 -13.59 2 3 0 44 197.259 4 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 111-114? Alfa-Aesar
Melting_Point 111-114° Alfa-Aesar
MP 113 - 115 Enamine Building Blocks
MP 113...115 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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

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