COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK748787
Chemical Name: ethyl4-{[4-(4-chlorophenyl)-3-cyano-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-3-oxobutanoate
Smiles: CCOC(=O)CC(=O)CSc1nc2CCCCc2c(c1C#N)c1ccc(cc1)Cl

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Molecular Weight: 428.94
Empirical Formula: C22H21ClN2O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.167
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 105
Number of rings: 3

     

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