COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK840403
Chemical Name: 7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-8-(cyclohexylamino)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(NC2CCCCC2)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)Cl

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Molecular Weight: 447.92
Empirical Formula: C21H26ClN5O4

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 3.57
Rotatable bonds: 6
H-donors: 3
H-acceptors: 4
PSA: 108
Number of rings: 4

     

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