COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL150778
Chemical Name: 8-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-7-[3-(4-bromophenoxy)-2-hydroxypropyl]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Brc1ccc(cc1)OCC(Cn1c(N/N=C/c2ccc(cc2)Br)nc2c1c(O)nc(=O)n2C)O

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Molecular Weight: 592.25
Empirical Formula: C22H20Br2N6O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.528
Rotatable bonds: 7
H-donors: 3
H-acceptors: 4
PSA: 124
Number of rings: 4

     

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