COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK070805
Chemical Name: (2E)-N-benzyl-N-methyl-3-(6-nitro-1,3-benzodioxol-5-yl)-2-(2-oxopyridin-1(2H)-yl)prop-2-enamide
Smiles: CN(C(=O)/C(=C\c1cc2OCOc2cc1[N+](=O)[O-])/n1ccccc1=O)Cc1ccccc1

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Molecular Weight: 433.42
Empirical Formula: C23H19N3O6

Physical State: Dry powder
Available Amount: 323 mg

Lipinsky:
logP: 3.03
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 104
Number of rings: 4

     

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