COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK086524
Chemical Name: methyl4-(2-bromophenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccccc1Br)C(=O)OC)C

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Molecular Weight: 482.37
Empirical Formula: C25H24BrNO4

Physical State: Dry powder
Available Amount: 202 mg

Lipinsky:
logP: 3.995
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 64
Number of rings: 4

     

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