COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK826798
Chemical Name: methyl2-[({[4-(2-chlorophenyl)-3-cyano-6-methyl-5-(phenylcarbamoyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetyl)amino]benzoate
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C(=O)OC)NC(=C(C1c1ccccc1Cl)C(=O)Nc1ccccc1)C

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Molecular Weight: 573.07
Empirical Formula: C30H25ClN4O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.304
Rotatable bonds: 7
H-donors: 3
H-acceptors: 4
PSA: 145
Number of rings: 4

     

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