COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK640047
Chemical Name: 8-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-6-hydroxy-3-methyl-7-pentyl-3,7-dihydro-2H-purin-2-one
Smiles: CCCCCn1c(N/N=C/c2ccc(cc2)Br)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 433.31
Empirical Formula: C18H21BrN6O2

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 4.216
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 95
Number of rings: 3

     

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