COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL024284
Chemical Name: methyl6-tert-butyl-2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCC(C2)C(C)(C)C)NC1=NS(=O)(=O)c2c1cccc2

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Molecular Weight: 432.56
Empirical Formula: C21H24N2O4S2

Physical State: Dry powder
Available Amount: 1631 mg

Lipinsky:
logP: 6.983
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 113
Number of rings: 4

     

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