COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK426046
Chemical Name: 6-bromo-2-(4-tert-butylphenyl)-N-[3-carbamoyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]quinoline-4-carboxamide
Smiles: CCC(C1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1cc(nc2c1cc(Br)cc2)c1ccc(cc1)C(C)(C)C)(C)C

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Molecular Weight: 632.66
Empirical Formula: C34H38BrN3O2S

Physical State: Dry powder
Available Amount: 345 mg

Lipinsky:
logP: 10.975
Rotatable bonds: 4
H-donors: 3
H-acceptors: 2
PSA: 113
Number of rings: 5

     

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