COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL050712
Chemical Name: (8E)-1-benzyl-8-[(2E)-3,4-dihydronaphthalen-1(2H)-ylidenehydrazinylidene]-3,7-dimethyl-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(Cc2ccccc2)c(=O)c2c1[nH]/c(=N\N=C\1/CCCc3c1cccc3)/n2C

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Molecular Weight: 428.49
Empirical Formula: C24H24N6O2

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 3.492
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 80
Number of rings: 5

     

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