UCSF

ZINC01235083

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 13th, 2004 14 No

Popular Name: 1-Methyl-2-oxo-1,2-dihydroquinoline-4-carbaldehyde 1-Methyl-2-oxo-1,2-dihydroquinol…

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CAS Numbers: , 15112-98-8 , [15112-98-8]

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) 1.70 5.06 -10.07 0 3 0 39 187.198 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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