COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK537512
Chemical Name: 6-({2-[(4-chloro-2,5-dimethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-N-(2-methylphenyl)-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(OC)c(cc2OC)Cl)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1C)C

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Molecular Weight: 589.11
Empirical Formula: C31H29ClN4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.867
Rotatable bonds: 6
H-donors: 3
H-acceptors: 4
PSA: 137
Number of rings: 4

     

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