COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK725907
Chemical Name: tert-butyl4-(4-chlorophenyl)-5-cyano-6-({2-[(4-ethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)OC(C)(C)C)c1ccc(cc1)Cl

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Molecular Weight: 540.08
Empirical Formula: C28H30ClN3O4S

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 5.951
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 125
Number of rings: 3

     

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