COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK887298
Chemical Name: methyl5-cyano-6-({2-[(3,4-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(2-fluorophenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: COC(=O)C1=C(C)NC(=C(C1c1ccccc1F)C#N)SCC(=O)Nc1ccc(c(c1)C)C

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Molecular Weight: 465.55
Empirical Formula: C25H24FN3O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.556
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 116
Number of rings: 3

     

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