PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCC(N2Cc3cccc(CN4CCC(N5CCN(C(c6ccccc6)c6ccccc6)CC5)C(F)(F)C4)c3C2=O)C(=O)N1

Compound summary

Compound IDPGDB_C000823

FormulaC36H39F2N5O3

Molecular weight627.736

InChIKeyBTZKZDZWDDYWSF-UHFFFAOYSA-N

Physicochemical properties

Exact mass627.3021

RDKit cLogP4.06

TPSA76.2

HBD / HBA1 / 6

Rotatable bonds7

Heavy atoms46

Hetero atoms10

Rings / aromatic7 / 3

Fraction Csp30.42

Formal charge0

Fragments1

Activity compounds and values

Activity records

8 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
% Degradation	-	=	0-20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF2	-	-	CN120548310A	PGDB_A008932	PGDB_C000823	PGDB_AS002025	View
% Inhibition	-	=	40-50	%	0.1 uM	24 h	-	-	-	CN120548310A	PGDB_A010895	PGDB_C000823	PGDB_AS000584	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	WEE1	-	-	CN120548310A	PGDB_A023354	PGDB_C000823	PGDB_AS001655	View
% Degradation	-	=	0-20	%	Concentration series: 500 nM, 50 nM	24 h	CSNK1A1	-	-	CN120548310A	PGDB_A026073	PGDB_C000823	PGDB_AS001449	View
% Degradation	-	=	0-20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF1	-	-	CN120548310A	PGDB_A035053	PGDB_C000823	PGDB_AS000946	View
% Inhibition	-	=	40-50	%	1 uM	24 h	-	-	-	CN120548310A	PGDB_A051815	PGDB_C000823	PGDB_AS000125	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	GSPT1	-	-	CN120548310A	PGDB_A065947	PGDB_C000823	PGDB_AS001466	View
% Degradation	-	=	0-20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF3	-	-	CN120548310A	PGDB_A076139	PGDB_C000823	PGDB_AS000102	View

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