COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK536855
Chemical Name: ethyl2-({[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)Cn2nc(c(c2C)Br)C(F)(F)F)sc2c1CCC(C2)C(C)(C)C

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Molecular Weight: 550.44
Empirical Formula: C22H27BrF3N3O3S

Physical State: Dry powder
Available Amount: 260 mg

Lipinsky:
logP: 8.102
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 101
Number of rings: 3

     

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