COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK045961
Chemical Name: 2-(propan-2-yloxy)ethyl7-(3-methoxyphenyl)-2-methyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COc1cccc(c1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccc(s1)C)C(=O)OCCOC(C)C)C

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Molecular Weight: 495.64
Empirical Formula: C28H33NO5S

Physical State: Dry powder
Available Amount: 257 mg

Lipinsky:
logP: 3.937
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 102
Number of rings: 4

     

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