COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK099784
Chemical Name: 7-[3-(4-bromophenoxy)-2-hydroxypropyl]-8-[(2E)-2-(2-hydroxybenzylidene)hydrazinyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(N/N=C/c2ccccc2O)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)Br

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Molecular Weight: 529.35
Empirical Formula: C22H21BrN6O5

Physical State: Dry powder
Available Amount: 426 mg

Lipinsky:
logP: 3.914
Rotatable bonds: 8
H-donors: 4
H-acceptors: 5
PSA: 141
Number of rings: 4

     

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