COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK449734
Chemical Name: propan-2-yl2-({[5-(5-chlorothiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CC(OC(=O)c1c(NC(=O)c2cc3n(n2)c(cc(n3)c2ccc(s2)Cl)C(F)(F)F)sc2c1CCC(C2)c1ccccc1)C

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Molecular Weight: 645.13
Empirical Formula: C30H24ClF3N4O3S2

Physical State: Dry powder
Available Amount: 850 mg

Lipinsky:
logP: 9.458
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 142
Number of rings: 6

     

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