COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK611419
Chemical Name: (2E)-3-[2-(4-benzylpiperidin-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(phenylsulfonyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1c(nc2n(c1=O)cccc2C)N1CCC(CC1)Cc1ccccc1)/S(=O)(=O)c1ccccc1

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Molecular Weight: 524.64
Empirical Formula: C30H28N4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.186
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 102
Number of rings: 5

     

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