COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK363333
Chemical Name: propan-2-yl4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOc1cc(cc(c1O)Br)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC(C)C

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Molecular Weight: 492.41
Empirical Formula: C24H30BrNO5

Physical State: Dry powder
Available Amount: 185 mg

Lipinsky:
logP: 4.163
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 84
Number of rings: 3

     

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