COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK363748
Chemical Name: 2-methylpropyl4-(6-bromo-1,3-benzodioxol-5-yl)-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(C2c1cc2OCOc2cc1Br)C(=O)OCC(C)C)C

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Molecular Weight: 568.46
Empirical Formula: C29H30BrNO6

Physical State: Dry powder
Available Amount: 252 mg

Lipinsky:
logP: 5.4
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 83
Number of rings: 5

     

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