COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK886663
Chemical Name: 2-({4-[4-(benzyloxy)phenyl]-3-cyano-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl}sulfanyl)-N-(4-ethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)CC)NC2=C(C1c1ccc(cc1)OCc1ccccc1)C(=O)CCC2

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Molecular Weight: 549.69
Empirical Formula: C33H31N3O3S

Physical State: Dry powder
Available Amount: 74 mg

Lipinsky:
logP: 5.937
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 116
Number of rings: 5

     

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