COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK886695
Chemical Name: methyl5-cyano-6-({2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(2-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1ccccc1OC)C#N)SCC(=O)Nc1c(C)cccc1C

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Molecular Weight: 479.56
Empirical Formula: C25H25N3O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.366
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 142
Number of rings: 3

     

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