COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053320
Chemical Name: ethyl2-[({[3-cyano-5-hydroxy-4-(5-methylfuran-2-yl)-4,6,7,8-tetrahydroquinolin-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(C3=C(CCCC3=N2)O)c2ccc(o2)C)sc2c1CCCC2

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Molecular Weight: 551.69
Empirical Formula: C28H29N3O5S2

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 7.226
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 178
Number of rings: 5

     

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