COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK886289
Chemical Name: ethyl2-[({[3-cyano-6-oxo-4-(thiophen-2-yl)-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSC2=C(C#N)C(CC(=O)N2)c2cccs2)sc2c1CCCC2

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Molecular Weight: 501.65
Empirical Formula: C23H23N3O4S3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.383
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 190
Number of rings: 4

     

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