COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK834846
Chemical Name: 7-[(2Z)-3-chlorobut-2-en-1-yl]-8-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)/C=N/Nc1nc2c(n1C/C=C(\Cl)/C)c(=O)[nH]c(=O)n2C

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Molecular Weight: 402.84
Empirical Formula: C18H19ClN6O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.67
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 100
Number of rings: 3

     

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