COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK904636
Chemical Name: (2E)-3-[2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-(3-methoxypropyl)prop-2-enamide
Smiles: COCCCNC(=O)/C(=C/c1c(nc2n(c1=O)cccc2)N1CCCCCC1)/C#N

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Molecular Weight: 409.49
Empirical Formula: C22H27N5O3

Physical State: Dry powder
Available Amount: 401 mg

Lipinsky:
logP: 0.513
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 98
Number of rings: 3

     

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