COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK725922
Chemical Name: 2-(benzylsulfanyl)-4-(2-chlorophenyl)-6-hydroxy-5-(thiophen-2-ylcarbonyl)-6-(trifluoromethyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(SCc2ccccc2)NC(C(C1c1ccccc1Cl)C(=O)c1cccs1)(O)C(F)(F)F

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Molecular Weight: 535.01
Empirical Formula: C25H18ClF3N2O2S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 8.883
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 126
Number of rings: 4

     

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