COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK920760
Chemical Name: 2-amino-N-(butan-2-yl)-1-{[(E)-(3,4-dihydroxyphenyl)methylidene]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCC(NC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(c(c1)O)O)C

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Molecular Weight: 418.46
Empirical Formula: C22H22N6O3

Physical State: Dry powder
Available Amount: 394 mg

Lipinsky:
logP: 2.736
Rotatable bonds: 7
H-donors: 5
H-acceptors: 3
PSA: 138
Number of rings: 4

     

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