COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL050062
Chemical Name: 8-[(2Z)-2-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)hydrazinyl]-1,3-dimethyl-7-(4-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC1=NC(=O)/C(=N\Nc2nc3c(n2Cc2ccc(cc2)C)c(=O)n(c(=O)n3C)C)/C(=N1)O

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Molecular Weight: 438.4
Empirical Formula: C19H18N8O5

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 0.634
Rotatable bonds: 4
H-donors: 3
H-acceptors: 5
PSA: 165
Number of rings: 4

     

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