COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK422402
Chemical Name: methyl2-({[6-bromo-2-(4-methylphenyl)quinolin-4-yl]carbonyl}amino)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)c2cc(nc3c2cc(Br)cc3)c2ccc(cc2)C)sc2c1CCC(C2)C(C)(C)C

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Molecular Weight: 591.57
Empirical Formula: C31H31BrN2O3S

Physical State: Dry powder
Available Amount: 1941 mg

Lipinsky:
logP: 10.555
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 96
Number of rings: 5

     

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