COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK725913
Chemical Name: tert-butyl4-(4-chlorophenyl)-6-({2-[(3-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)Cl)NC(=C(C1c1ccc(cc1)Cl)C(=O)OC(C)(C)C)C

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Molecular Weight: 530.47
Empirical Formula: C26H25Cl2N3O3S

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 6.131
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 116
Number of rings: 3

     

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