COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK582351
Chemical Name: methyl2-({(E)-[2-(3,4-dimethylphenyl)-1,3-dioxo-2,3-dihydroisoquinolin-4(1H)-ylidene]methyl}amino)benzoate
Smiles: COC(=O)c1ccccc1N/C=C\1/C(=O)N(c2ccc(c(c2)C)C)C(=O)c2c1cccc2

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Molecular Weight: 426.47
Empirical Formula: C26H22N2O4

Physical State: Dry powder
Available Amount: 158 mg

Lipinsky:
logP: 5.851
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 75
Number of rings: 4

     

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