COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK826390
Chemical Name: benzyl4-(4-chlorophenyl)-5-cyano-6-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: N#CC1=C(SCC(=O)NC2CCCCC2)NC(=C(C1c1ccc(cc1)Cl)C(=O)OCc1ccccc1)C

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Molecular Weight: 536.09
Empirical Formula: C29H30ClN3O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.583
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 116
Number of rings: 4

     

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