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Inhibitor Report for: CID155803782

CID155803782	Type	Piperazine
		Trifluoro
		Sulfur compound
		Sulfonamide
		Morpholine
		Pyrazole
	Other_Name	Compound 2 Remsberg et al.
	Chemical_Nomenclature	N,N-dimethyl-1-[4-[[2-morpholin-4-yl-4-(trifluoromethyl)phenyl]methyl]piperazine-1-carbonyl]pyrazole-4-sulfonamide
	Formula	C22H29F3N6O4S
	MW	530.6
	Paper	Remsberg_2021_Nat.Chem.Biol__
	Comment	ABHD17B IC50 0.96(0.8-1.2)microM LYPLA1 IC50 0.45(0.38-0.52)microM
	Gene_locus (2)
	CID	155803782
	Family (2)
	InChIKey	KJPLRPCRGIUKDJ-UHFFFAOYSA-N
	CanonicalSMILES	CN(C)S(=O)(=O)C1=CN(N=C1)C(=O)N2CCN(CC2)CC3=C(C=C(C=C3)C(F)(F)F)N4CCOCC4
	InChI	InChI=1S/C22H29F3N6O4S/c1-27(2)36(33,34)19-14-26-31(16-19)21(32)30-7-5-28(6-8-30)15-17-3-4-18(22(23,24)25)13-20(17)29-9-11-35-12-10-29/h3-4,13-14,16H,5-12,15H2,1-2H3