UCSF

ZINC02528941

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 17 Yes

Popular Name: 3'-Cyano-biphenyl-2-carboxylic acid 3'-Cyano-biphenyl-2-carboxylic acid

Find On: PubMed — Wikipedia — Google

CAS Number: 107916-96-1

Other Names:

MFCD04117367

YA-1006

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) 2.99 2.58 -48.69 0 3 -1 64 222.223 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID WO2000069834A1 IBM Patent Data

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