COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK539187
Chemical Name: 8-[(2Z)-2-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-1,3-dimethyl-7-(4-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)Cn1c(N/N=C/2\C(=O)Nc3c2cc(Br)cc3)nc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 522.36
Empirical Formula: C23H20BrN7O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.681
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 111
Number of rings: 5

     

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