UCSF

ZINC13809591

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 25th, 2008 16 Yes

Popular Name: Methyl biphenyl-2-carboxylate Methyl biphenyl-2-carboxylate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 16605-99-5 , [16605-99-5]

Other Names:

MFCD00452250

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) 3.52 8.54 -7.11 0 2 0 26 212.248 3 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US5814646 IBM Patent Data

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