COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK904651
Chemical Name: (2E)-3-[2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-(2-phenylethyl)prop-2-enamide
Smiles: N#C/C(=C\c1c(nc2n(c1=O)cccc2)N1CCCCCC1)/C(=O)NCCc1ccccc1

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Molecular Weight: 441.53
Empirical Formula: C26H27N5O2

Physical State: Dry powder
Available Amount: 393 mg

Lipinsky:
logP: 2.351
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 88
Number of rings: 4

     

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