COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK703941
Chemical Name: (2E)-2-[(4-methylphenyl)sulfonyl]-3-{1-phenyl-3-[4-(piperidin-1-ylsulfonyl)phenyl]-1H-pyrazol-4-yl}prop-2-enenitrile
Smiles: N#C/C(=C\c1cn(nc1c1ccc(cc1)S(=O)(=O)N1CCCCC1)c1ccccc1)/S(=O)(=O)c1ccc(cc1)C

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Molecular Weight: 572.71
Empirical Formula: C30H28N4O4S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.525
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 129
Number of rings: 5

     

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