COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK887385
Chemical Name: methyl5-cyano-6-({2-[(2-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-2-oxo-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1cc(OC)c(c(c1)OC)OC)C#N)SCC(=O)Nc1ccccc1CC

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Molecular Weight: 539.61
Empirical Formula: C27H29N3O7S

Physical State: Dry powder
Available Amount: 263 mg

Lipinsky:
logP: 4.961
Rotatable bonds: 8
H-donors: 2
H-acceptors: 7
PSA: 161
Number of rings: 3

     

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