COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK920802
Chemical Name: 2-amino-1-{[(E)-(3-chlorophenyl)methylidene]amino}-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1cccc(c1)Cl

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Molecular Weight: 462.98
Empirical Formula: C25H27ClN6O

Physical State: Dry powder
Available Amount: 404 mg

Lipinsky:
logP: 5.812
Rotatable bonds: 9
H-donors: 3
H-acceptors: 1
PSA: 98
Number of rings: 4

     

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