COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK538066
Chemical Name: benzyl4-(4-chlorophenyl)-5-cyano-2-methyl-6-({2-oxo-2-[(4-phenoxyphenyl)amino]ethyl}sulfanyl)-1,4-dihydropyridine-3-carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Oc2ccccc2)NC(=C(C1c1ccc(cc1)Cl)C(=O)OCc1ccccc1)C

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Molecular Weight: 622.14
Empirical Formula: C35H28ClN3O4S

Physical State: Dry powder
Available Amount: 417 mg

Lipinsky:
logP: 7.708
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 125
Number of rings: 5

     

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