COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK095712
Chemical Name: 8-{(2E)-2-[1-(4-bromophenyl)ethylidene]hydrazinyl}-3-methyl-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc(cc1)/C(=N/Nc1nc2c(n1CCc1ccccc1)c(=O)[nH]c(=O)n2C)/C

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Molecular Weight: 481.35
Empirical Formula: C22H21BrN6O2

Physical State: Dry powder
Available Amount: 496 mg

Lipinsky:
logP: 4.51
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 91
Number of rings: 4

     

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