COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK003490
Chemical Name: methyl2,7,7-trimethyl-5-oxo-4-(3-phenoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COC(=O)C1=C(C)NC2=C(C1c1cccc(c1)Oc1ccccc1)C(=O)CC(C2)(C)C

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Molecular Weight: 417.5
Empirical Formula: C26H27NO4

Physical State: Dry powder
Available Amount: 184 mg

Lipinsky:
logP: 4.668
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 64
Number of rings: 4

     

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