COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053327
Chemical Name: (8E)-7-(2-chlorobenzyl)-8-{(2E)-[1-(furan-2-yl)ethylidene]hydrazinylidene}-1,3-dimethyl-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Smiles: C/C(=N\N=c\1/[nH]c2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C)/c1ccco1

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Molecular Weight: 426.86
Empirical Formula: C20H19ClN6O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.409
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 93
Number of rings: 4

     

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