COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK445229
Chemical Name: (2E)-3-[1-(4-methylbenzyl)-1H-indol-3-yl]-2-(phenylsulfonyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cn(c2c1cccc2)Cc1ccc(cc1)C)/S(=O)(=O)c1ccccc1

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Molecular Weight: 412.51
Empirical Formula: C25H20N2O2S

Physical State: Dry powder
Available Amount: 504 mg

Lipinsky:
logP: 5.473
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 71
Number of rings: 4

     

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