UCSF

ZINC01494945

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 12 Yes

Popular Name: Terephthalic acid monoamide Terephthalic acid monoamide

Find On: PubMed — Wikipedia — Google

CAS Numbers: 6051-43-0 , [6051-43-0]

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) 0.67 0.9 -50.09 2 4 -1 83 164.14 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 239 - 241 Enamine Building Blocks
MP 239...241 Enamine Building Blocks
MP 248 TCI
purity 9.500000000000000e+001 Enamine Building Blocks
Purity 90% Matrix Scientific
purity 95 Enamine Building Blocks
Purity 95% Fluorochem
Purity 98%,99% APIChem
MP >330° Oakwood Chemical
MP >340° Matrix Scientific
Warnings IRRITANT Matrix Scientific

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

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