COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK781273
Chemical Name: ethyl2-methyl-4-(4-{[(1-methyl-1H-imidazol-2-yl)sulfanyl]methyl}thiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=C(C)NC2=C(C1c1scc(c1)CSc1nccn1C)C(=O)CCC2

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Molecular Weight: 443.59
Empirical Formula: C22H25N3O3S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.487
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 126
Number of rings: 4

     

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