COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK535645
Chemical Name: 7-benzyl-8-{(2E)-2-[(2Z)-2-bromo-3-phenylprop-2-en-1-ylidene]hydrazinyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Br/C(=C\c1ccccc1)/C=N/Nc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

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Molecular Weight: 493.36
Empirical Formula: C23H21BrN6O2

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 5.294
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 82
Number of rings: 4

     

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