COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK534997
Chemical Name: 3-bromo-N-{3-[(4-methylphenyl)sulfonyl]-1-(1-phenylethyl)-1H-pyrrolo[2,3-b]quinoxalin-2-yl}benzamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(NC(=O)c2cccc(c2)Br)n(c2c1nc1ccccc1n2)C(c1ccccc1)C

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Molecular Weight: 625.55
Empirical Formula: C32H25BrN4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.676
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 102
Number of rings: 6

     

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