COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561735
Chemical Name: 2-{[3-cyano-5-hydroxy-4-(4-methoxyphenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Smiles: COc1ccc(cc1)C1C(=C(SCC(=O)Nc2ccc(cc2)C(C)C)N=C2C1=C(O)CC(C2)(C)C)C#N

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Molecular Weight: 515.68
Empirical Formula: C30H33N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.124
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 120
Number of rings: 4

     

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