COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK582064
Chemical Name: 6-hydroxy-3-methyl-8-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-7-nonyl-3,7-dihydro-2H-purin-2-one
Smiles: CCCCCCCCCn1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c1c(O)nc(=O)n2C

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Molecular Weight: 455.52
Empirical Formula: C22H29N7O4

Physical State: Dry powder
Available Amount: 200 mg

Lipinsky:
logP: 5.33
Rotatable bonds: 10
H-donors: 2
H-acceptors: 4
PSA: 140
Number of rings: 3

     

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