COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK004531
Chemical Name: cyclohexyl4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COc1cc(cc(c1O)Br)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)OC1CCCCC1

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Molecular Weight: 566.49
Empirical Formula: C30H32BrNO5

Physical State: Dry powder
Available Amount: 764 mg

Lipinsky:
logP: 5.445
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 84
Number of rings: 5

     

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