COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK643283
Chemical Name: 6-hydroxy-3-methyl-7-nonyl-8-[(2E)-2-(1-phenylbutylidene)hydrazinyl]-3,7-dihydro-2H-purin-2-one
Smiles: CCC/C(=N\Nc1nc2c(n1CCCCCCCCC)c(O)nc(=O)n2C)/c1ccccc1

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Molecular Weight: 452.6
Empirical Formula: C25H36N6O2

Physical State: Dry powder
Available Amount: 107 mg

Lipinsky:
logP: 6.341
Rotatable bonds: 12
H-donors: 2
H-acceptors: 2
PSA: 95
Number of rings: 3

     

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