COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK891222
Chemical Name: 4-(2-chlorophenyl)-6-hydroxy-2-[(2-oxo-2-phenylethyl)sulfanyl]-5-(thiophen-2-ylcarbonyl)-6-(trifluoromethyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(SCC(=O)c2ccccc2)NC(C(C1c1ccccc1Cl)C(=O)c1cccs1)(O)C(F)(F)F

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Molecular Weight: 563.02
Empirical Formula: C26H18ClF3N2O3S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 8.861
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 143
Number of rings: 4

     

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