COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK470196
Chemical Name: (2E)-3-[1-benzyl-3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-2-(phenylsulfonyl)prop-2-enenitrile
Smiles: COc1ccc(cc1)c1nn(cc1/C=C(/S(=O)(=O)c1ccccc1)\C#N)Cc1ccccc1

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Molecular Weight: 455.54
Empirical Formula: C26H21N3O3S

Physical State: Dry powder
Available Amount: 392 mg

Lipinsky:
logP: 4.269
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 93
Number of rings: 4

     

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