COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL003859
Chemical Name: 3-methyl-8-(4-phenylpiperazin-1-yl)-7-[2-(pyrimidin-2-ylsulfanyl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)c2c(n1C)nc(n2CCSc1ncccn1)N1CCN(CC1)c1ccccc1

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Molecular Weight: 464.55
Empirical Formula: C22H24N8O2S

Available Amount: 0 mg

Lipinsky:
logP: 1.45
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 124
Number of rings: 5

     

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