COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL337191
Chemical Name: 1-{3-[(1E)-2-cyano-3-(cyclohexylamino)-3-oxoprop-1-en-1-yl]-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}piperidine-4-carboxamide
Smiles: N#C/C(=C\c1c(nc2n(c1=O)cccc2)N1CCC(CC1)C(=O)N)/C(=O)NC1CCCCC1

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Molecular Weight: 448.52
Empirical Formula: C24H28N6O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.183
Rotatable bonds: 4
H-donors: 3
H-acceptors: 3
PSA: 131
Number of rings: 4

     

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