UCSF

ZINC15884445

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 2nd, 2008 11 No

Popular Name: 3-(Pyridin-2-yl)acrylic acid 3-(Pyridin-2-yl)acrylic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 7340-22-9 , [7340-22-9]

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) 0.56 3.84 -53.03 0 3 -1 53 148.141 2 ↓
Lo Low (pH 4.5-6) 0.56 4.06 -55.98 1 3 0 54 149.149 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 201 - 203 Enamine Building Blocks
MP 201...203 Enamine Building Blocks
MP 202 - 204 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0775139A1; WO1996005201A1 IBM Patent Data

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