COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL327566
Chemical Name: pentyl2-{[(2E)-3-phenylprop-2-enoyl]amino}-1-(prop-2-en-1-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCCOC(=O)c1c(NC(=O)/C=C/c2ccccc2)n(c2c1nc1ccccc1n2)CC=C

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Molecular Weight: 468.56
Empirical Formula: C28H28N4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.356
Rotatable bonds: 9
H-donors: 1
H-acceptors: 3
PSA: 86
Number of rings: 4

     

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