COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK554989
Chemical Name: (2E)-N-[5-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1-phenyl-1H-1,2,4-triazol-3-yl]-3-(3-nitrophenyl)prop-2-enamide
Smiles: O=C(Nc1nc(n(n1)c1ccccc1)N1C(=O)c2c(C1=O)cccc2)/C=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 480.44
Empirical Formula: C25H16N6O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.618
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 143
Number of rings: 5

     

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