COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK343450
Chemical Name: 5-(1,3-benzodioxol-5-yl)-N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: CCOc1ccc(cc1)Oc1cc(NC(=O)c2cc3n(n2)C(CC(N3)c2ccc3c(c2)OCO3)C(F)(F)F)cc(c1)[N+](=O)[O-]

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Molecular Weight: 611.53
Empirical Formula: C29H24F3N5O7

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 5.902
Rotatable bonds: 4
H-donors: 2
H-acceptors: 7
PSA: 141
Number of rings: 6

     

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