COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK599438
Chemical Name: 7-[2-hydroxy-3-(3-methylphenoxy)propyl]-8-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)OCC(Cn1c(NCCCn2cncc2)nc2c1c(=O)n(C)c(=O)n2C)O

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Molecular Weight: 467.53
Empirical Formula: C23H29N7O4

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 2.094
Rotatable bonds: 10
H-donors: 2
H-acceptors: 4
PSA: 117
Number of rings: 4

     

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