COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK400466
Chemical Name: methyl6-tert-butyl-2-[(chloroacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)CCl)sc2c1CCC(C2)C(C)(C)C

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Molecular Weight: 343.87
Empirical Formula: C16H22ClNO3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.585
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 83
Number of rings: 2

     

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