COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK008781
Chemical Name: 7-(3,4-dichlorobenzyl)-8-[(2,3-dihydroxypropyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCC(CNc1nc2c(n1Cc1ccc(c(c1)Cl)Cl)c(=O)n(c(=O)n2C)C)O

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Molecular Weight: 428.27
Empirical Formula: C17H19Cl2N5O4

Physical State: Dry powder
Available Amount: 88 mg

Lipinsky:
logP: 1.722
Rotatable bonds: 7
H-donors: 3
H-acceptors: 4
PSA: 110
Number of rings: 3

     

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