COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK886013
Chemical Name: ethyl6-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-(4-chlorophenyl)-5-cyano-2-phenyl-1,4-dihydropyridine-3-carboxylate
Smiles: CCOC(=O)C1=C(NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)NCc1ccccc1)c1ccccc1

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Molecular Weight: 544.07
Empirical Formula: C30H26ClN3O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.014
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 116
Number of rings: 4

     

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