COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK363238
Chemical Name: pentyl4-(4-hydroxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCCCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)O)C(=O)CCC2

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Molecular Weight: 399.49
Empirical Formula: C23H29NO5

Physical State: Dry powder
Available Amount: 487 mg

Lipinsky:
logP: 2.737
Rotatable bonds: 9
H-donors: 2
H-acceptors: 5
PSA: 84
Number of rings: 3

     

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