COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK373712
Chemical Name: 4-[4-(diethylamino)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(C)NC2=C(C1c1ccc(cc1)N(CC)CC)C(=O)CC(C2)(C)C

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Molecular Weight: 363.5
Empirical Formula: C23H29N3O

Physical State: Dry powder
Available Amount: 13 mg

Lipinsky:
logP: 3.994
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 56
Number of rings: 3

     

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