COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK588735
Chemical Name: 2-({(E)-[2-(2,4-dimethylphenyl)-1,3-dioxo-2,3-dihydroisoquinolin-4(1H)-ylidene]methyl}amino)benzoicacid
Smiles: Cc1ccc(c(c1)C)N1C(=O)/C(=C/Nc2ccccc2C(=O)O)/c2c(C1=O)cccc2

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Molecular Weight: 412.44
Empirical Formula: C25H20N2O4

Physical State: Dry powder
Available Amount: 218 mg

Lipinsky:
logP: 5.55
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 86
Number of rings: 4

     

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