COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK558872
Chemical Name: 8-[(2E)-2-(5-bromo-2-hydroxybenzylidene)hydrazinyl]-7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OC(Cn1c(N/N=C/c2cc(Br)ccc2O)nc2c1c(O)nc(=O)n2C)COc1ccc(cc1)Cl

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Molecular Weight: 563.79
Empirical Formula: C22H20BrClN6O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.426
Rotatable bonds: 9
H-donors: 4
H-acceptors: 5
PSA: 144
Number of rings: 4

     

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