COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK960349
Chemical Name: 2,7,7-trimethyl-4-[4-(methylsulfanyl)phenyl]-5-oxo-N-(pyridin-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: CSc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)Nc1ccccn1

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Molecular Weight: 433.57
Empirical Formula: C25H27N3O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.369
Rotatable bonds: 1
H-donors: 2
H-acceptors: 2
PSA: 96
Number of rings: 4

     

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