COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456961
Chemical Name: diethyl5-[(3,4-dihydroisoquinolin-2(1H)-ylcarbonothioyl)amino]-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(NC(=S)N2CCc3c(C2)cccc3)sc(c1C)C(=O)OCC

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Molecular Weight: 432.56
Empirical Formula: C21H24N2O4S2

Physical State: Dry powder
Available Amount: 115 mg

Lipinsky:
logP: 6.388
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 128
Number of rings: 3

     

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