COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK590958
Chemical Name: 8-(cyclohexylamino)-6-hydroxy-7-[2-(4-methoxyphenyl)ethyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: COc1ccc(cc1)CCn1c(NC2CCCCC2)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 397.48
Empirical Formula: C21H27N5O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.236
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 91
Number of rings: 4

     

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