COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455076
Chemical Name: (2E)-3-[1-(3-methoxybenzyl)-1H-indol-3-yl]-2-(phenylsulfonyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cn(c2c1cccc2)Cc1cccc(c1)OC)/S(=O)(=O)c1ccccc1

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Molecular Weight: 428.51
Empirical Formula: C25H20N2O3S

Physical State: Dry powder
Available Amount: 486 mg

Lipinsky:
logP: 4.928
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 80
Number of rings: 4

     

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