UCSF

ZINC04502690

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 5th, 2005 15 Yes

Popular Name: 8-Methoxy-chroman-3-carboxylic acid 8-Methoxy-chroman-3-carboxylic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 108088-19-3 , [108088-19-3]

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) 1.41 5.65 -46.55 0 4 -1 59 207.205 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 174 - 176 Enamine Building Blocks
MP 174...176 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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