COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK002011
Chemical Name: ethyl6-cyano-2-{[(3-methoxy-4-propoxyphenyl)carbonyl]amino}-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCCOc1ccc(cc1OC)C(=O)Nc1sc2c(c1C(=O)OCC)CCC(C2)(C#N)c1ccccc1

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Molecular Weight: 518.63
Empirical Formula: C29H30N2O5S

Physical State: Dry powder
Available Amount: 667 mg

Lipinsky:
logP: 7.733
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 125
Number of rings: 4

     

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