COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK990144
Chemical Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(thiophen-2-ylsulfonyl)-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: Nc1n(Cc2ccc3c(c2)OCO3)c2c(c1S(=O)(=O)c1cccs1)nc1c(n2)cccc1

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Molecular Weight: 464.53
Empirical Formula: C22H16N4O4S2

Physical State: Dry powder
Available Amount: 376 mg

Lipinsky:
logP: 4.675
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 145
Number of rings: 6

     

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