COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL240530
Chemical Name: (2E)-3-[9-methyl-2-(3-methylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-[(4-methylphenyl)sulfonyl]prop-2-enenitrile
Smiles: N#C/C(=C\c1c(nc2n(c1=O)cccc2C)N1CCCC(C1)C)/S(=O)(=O)c1ccc(cc1)C

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Molecular Weight: 462.57
Empirical Formula: C25H26N4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.147
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 102
Number of rings: 4

     

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