COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK045077
Chemical Name: tetrahydrofuran-2-ylmethyl4-(4-bromophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: Brc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OCC1CCCO1

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Molecular Weight: 474.39
Empirical Formula: C24H28BrNO4

Physical State: Dry powder
Available Amount: 200 mg

Lipinsky:
logP: 3.482
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 64
Number of rings: 4

     

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