UCSF

ZINC16947032

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2008 16 Yes

Popular Name: 5-(P-tolyl)nicotinic acid 5-(P-tolyl)nicotinic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 893737-23-0 , [893737-23-0]

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) 2.66 6.42 -48.48 0 3 -1 53 212.228 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 266 - 268 Enamine Building Blocks
MP 266...268 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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