COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK826587
Chemical Name: ethyl6-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-5-cyano-4-(4-methylphenyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Smiles: CCOC(=O)C1=C(NC(=C(C1c1ccc(cc1)C)C#N)SCC(=O)c1ccc(cc1)Br)c1ccccc1

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Molecular Weight: 573.51
Empirical Formula: C30H25BrN2O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 7.318
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 104
Number of rings: 4

     

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