COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL017435
Chemical Name: propyl2-[(cyanoacetyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCCOC(=O)c1c(NC(=O)CC#N)sc2c1CCC(C2)C

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Molecular Weight: 320.41
Empirical Formula: C16H20N2O3S

Physical State: Dry powder
Available Amount: 1100 mg

Lipinsky:
logP: 4.349
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 2

     

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