COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK012043
Chemical Name: cyclopentyl4-(3-bromo-4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COc1ccc(cc1Br)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC1CCCC1

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Molecular Weight: 460.37
Empirical Formula: C23H26BrNO4

Physical State: Dry powder
Available Amount: 204 mg

Lipinsky:
logP: 3.626
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 64
Number of rings: 4

     

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