COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK540494
Chemical Name: 7-[3-(2,4-dichlorophenoxy)-2-hydroxypropyl]-8-{[2-(dimethylamino)ethyl]amino}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(NCCN(C)C)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1Cl)Cl

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Molecular Weight: 471.34
Empirical Formula: C19H24Cl2N6O4

Physical State: Dry powder
Available Amount: 317 mg

Lipinsky:
logP: 2.223
Rotatable bonds: 8
H-donors: 3
H-acceptors: 4
PSA: 111
Number of rings: 3

     

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