COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK945384
Chemical Name: 2-{3-[7-(4-ethoxyphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]propyl}-1H-isoindole-1,3(2H)-dione
Smiles: CCOc1ccc(cc1)n1c(C)c(c2c1ncn1c2nc(n1)CCCN1C(=O)c2c(C1=O)cccc2)C

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Molecular Weight: 494.55
Empirical Formula: C28H26N6O3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.58
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 94
Number of rings: 6

     

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