COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK886028
Chemical Name: 2-{[3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C)NC2=C(C1c1ccc(cc1)OC)C(=O)CC(C2)(C)C

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Molecular Weight: 487.62
Empirical Formula: C28H29N3O3S

Physical State: Dry powder
Available Amount: 145 mg

Lipinsky:
logP: 4.783
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 116
Number of rings: 4

     

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