COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK358712
Chemical Name: 1,3-dimethyl-7-[2-oxo-2-(3-phenyl-1H-indol-2-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=C(c1[nH]c2c(c1c1ccccc1)cccc2)Cn1cnc2c1c(=O)n(C)c(=O)n2C

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Molecular Weight: 413.44
Empirical Formula: C23H19N5O3

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 2.36
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 91
Number of rings: 5

     

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