UCSF

ZINC00035862

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2005 21 Yes

Popular Name: 2-(3,4-Dimethylphenyl)quinoline-4-carboxylic acid 2-(3,4-Dimethylphenyl)quinoline-…

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CAS Numbers: , 20389-06-4 , [20389-06-4]

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) 4.46 0.99 -52.64 0 3 -1 53 276.315 2 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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