COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL235436
Chemical Name: ethyl1-(2-methoxyphenyl)-2-{[(2E)-3-(3-nitrophenyl)prop-2-enoyl]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-])n(c2c1nc1ccccc1n2)c1ccccc1OC

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Molecular Weight: 537.53
Empirical Formula: C29H23N5O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.304
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 141
Number of rings: 5

     

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