COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK809524
Chemical Name: methyl2-({2,2,2-trichloro-1-[(phenoxyacetyl)amino]ethyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)NC(C(Cl)(Cl)Cl)NC(=O)COc1ccccc1

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Molecular Weight: 491.82
Empirical Formula: C20H21Cl3N2O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 7.841
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 104
Number of rings: 3

     

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