COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK180096
Chemical Name: 4-{[(1,1-dioxido-1,2-benzothiazol-3-yl)(4-methylphenyl)amino]methyl}-2-methoxyphenylthiophene-2-carboxylate
Smiles: COc1cc(ccc1OC(=O)c1cccs1)CN(C1=NS(=O)(=O)c2c1cccc2)c1ccc(cc1)C

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Molecular Weight: 518.61
Empirical Formula: C27H22N2O5S2

Physical State: Dry powder
Available Amount: 985 mg

Lipinsky:
logP: 5.269
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 114
Number of rings: 5

     

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