COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK891225
Chemical Name: methyl{[4-(2-chlorophenyl)-3,5-dicyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate
Smiles: N#CC1C(=O)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)OC

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Molecular Weight: 361.81
Empirical Formula: C16H12ClN3O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.596
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 128
Number of rings: 2

     

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