COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK823814
Chemical Name: (2E)-3-[3-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1-phenyl-1H-pyrazol-4-yl]-2-[(4-methylphenyl)sulfonyl]prop-2-enenitrile
Smiles: N#C/C(=C\c1cn(nc1c1ccc2c(c1)CC(O2)C)c1ccccc1)/S(=O)(=O)c1ccc(cc1)C

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Molecular Weight: 481.58
Empirical Formula: C28H23N3O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.813
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 93
Number of rings: 5

     

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