COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL036492
Chemical Name: methyl6-tert-butyl-2-({[3-chloro-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)c2nn3c(c2Cl)nc(cc3C(F)(F)F)c2ccccc2)sc2c1CCC(C2)C(C)(C)C

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Molecular Weight: 591.05
Empirical Formula: C28H26ClF3N4O3S

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 8.142
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 113
Number of rings: 5

     

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