COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK001976
Chemical Name: ethyl6-cyano-6-phenyl-2-[(phenylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccccc2)sc2c1CCC(C2)(C#N)c1ccccc1

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Molecular Weight: 430.53
Empirical Formula: C25H22N2O3S

Physical State: Dry powder
Available Amount: 482 mg

Lipinsky:
logP: 6.547
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 4

     

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