COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK724439
Chemical Name: methyl4-({[2-(thiophen-2-ylsulfonyl)-1,2,3,4-tetrahydroisoquinolin-3-yl]carbonyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)C1Cc2ccccc2CN1S(=O)(=O)c1cccs1

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Molecular Weight: 456.54
Empirical Formula: C22H20N2O5S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.508
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 129
Number of rings: 4

     

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