COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK439924
Chemical Name: methyl2-[(cyanoacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: N#CCC(=O)Nc1sc2c(c1C(=O)OC)CCCC2

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Molecular Weight: 278.33
Empirical Formula: C13H14N2O3S

Physical State: Dry powder
Available Amount: 856 mg

Lipinsky:
logP: 2.794
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 2

     

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