COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK364259
Chemical Name: 2,7,7-trimethyl-5-oxo-4-(3-phenoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(C)NC2=C(C1c1cccc(c1)Oc1ccccc1)C(=O)CC(C2)(C)C

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Molecular Weight: 384.48
Empirical Formula: C25H24N2O2

Physical State: Dry powder
Available Amount: 42 mg

Lipinsky:
logP: 4.814
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 62
Number of rings: 4

     

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