COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK842468
Chemical Name: ethyl3-cyano-2-({2-[(3,4-dimethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-5,6,7,8-tetrahydroquinoline-4-carboxylate
Smiles: CCOC(=O)c1c(C#N)c(SCC(=O)Nc2ccc(c(c2)OC)OC)nc2c1CCCC2

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Molecular Weight: 455.53
Empirical Formula: C23H25N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.567
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 135
Number of rings: 3

     

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