COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK826392
Chemical Name: benzyl6-({2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(4-chlorophenyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)C)NC(=C(C1c1ccc(cc1)Cl)C(=O)OCc1ccccc1)C

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Molecular Weight: 578.52
Empirical Formula: C30H25Cl2N3O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.839
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 116
Number of rings: 4

     

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