COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL017079
Chemical Name: methyl2-[(cyanoacetyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: N#CCC(=O)Nc1sc2c(c1C(=O)OC)CCC(C2)C

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Molecular Weight: 292.36
Empirical Formula: C14H16N2O3S

Physical State: Dry powder
Available Amount: 1146 mg

Lipinsky:
logP: 3.287
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 2

     

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