COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK059534
Chemical Name: 8-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)OCC(Cn1c(N/N=C/c2ccc(cc2)Cl)nc2c1c(=O)[nH]c(=O)n2C)O

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Molecular Weight: 498.93
Empirical Formula: C23H23ClN6O5

Physical State: Dry powder
Available Amount: 426 mg

Lipinsky:
logP: 3.635
Rotatable bonds: 6
H-donors: 3
H-acceptors: 5
PSA: 130
Number of rings: 4

     

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