COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL322760
Chemical Name: 7-(3-bromobenzyl)-8-{(2E)-2-[1-(4-hydroxyphenyl)ethylidene]hydrazinyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Oc1ccc(cc1)/C(=N/Nc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]c(=O)n2C)/C

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Molecular Weight: 483.32
Empirical Formula: C21H19BrN6O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.56
Rotatable bonds: 4
H-donors: 3
H-acceptors: 3
PSA: 111
Number of rings: 4

     

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