COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK714462
Chemical Name: 2-amino-N-butyl-1-{[(E)-(3-nitrophenyl)methylidene]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 431.45
Empirical Formula: C22H21N7O3

Physical State: Dry powder
Available Amount: 377 mg

Lipinsky:
logP: 3.333
Rotatable bonds: 6
H-donors: 3
H-acceptors: 3
PSA: 144
Number of rings: 4

     

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