COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK546000
Chemical Name: 3-[(4-methylphenyl)sulfonyl]-1-[1-(1-pentyl-1H-benzimidazol-2-yl)ethyl]-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: CCCCCn1c2ccccc2nc1C(n1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccc(cc1)C)C

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Molecular Weight: 552.7
Empirical Formula: C31H32N6O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.133
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 117
Number of rings: 6

     

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