COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK532786
Chemical Name: (2E)-N-[1-benzyl-3-(phenylsulfonyl)-1H-pyrrolo[2,3-b]quinoxalin-2-yl]-3-(3-nitrophenyl)prop-2-enamide
Smiles: O=C(Nc1n(Cc2ccccc2)c2c(c1S(=O)(=O)c1ccccc1)nc1c(n2)cccc1)/C=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 589.63
Empirical Formula: C32H23N5O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.909
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 148
Number of rings: 6

     

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