COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053620
Chemical Name: 2-{[3-cyano-5-hydroxy-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Smiles: COc1cc(cc(c1OC)OC)C1C(=C(SCC(=O)Nc2ccc(cc2)F)N=C2C1=C(O)CCC2)C#N

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Molecular Weight: 523.59
Empirical Formula: C27H26FN3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.664
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 138
Number of rings: 4

     

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