COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK373590
Chemical Name: 4-(2-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(C)NC2=C(C1c1ccccc1Cl)C(=O)CC(C2)(C)C

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Molecular Weight: 326.83
Empirical Formula: C19H19ClN2O

Physical State: Dry powder
Available Amount: 232 mg

Lipinsky:
logP: 3.417
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 52
Number of rings: 3

     

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