COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK540774
Chemical Name: 7-[3-(4-bromophenoxy)-2-hydroxypropyl]-8-{(2E)-2-[4-(dimethylamino)benzylidene]hydrazinyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(N/N=C/c2ccc(cc2)N(C)C)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)Br

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Molecular Weight: 556.42
Empirical Formula: C24H26BrN7O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.116
Rotatable bonds: 6
H-donors: 3
H-acceptors: 4
PSA: 124
Number of rings: 4

     

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