PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCC(N2Cc3c(CN4CCC(N5CCN(c6cccc(Cl)c6Cl)CC5)CC4)cccc3C2=O)C(=O)N1

Compound summary

Compound IDPGDB_C000771

FormulaC29H33Cl2N5O3

Molecular weight570.521

InChIKeyCXKSBEZTCPSEKC-UHFFFAOYSA-N

Physicochemical properties

Exact mass569.196

RDKit cLogP3.54

TPSA76.2

HBD / HBA1 / 6

Rotatable bonds5

Heavy atoms39

Hetero atoms10

Rings / aromatic6 / 2

Fraction Csp30.48

Formal charge0

Fragments1

Activity compounds and values

Activity records

7 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
% Degradation	-	=	0-20	%	Concentration series: 500 nM, 50 nM	24 h	CSNK1A1	-	-	CN120548310A	PGDB_A011961	PGDB_C000771	PGDB_AS001449	View
% Degradation	-	=	0-20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF3	-	-	CN120548310A	PGDB_A034673	PGDB_C000771	PGDB_AS000102	View
% Degradation	-	=	0-20	%	Concentration series: 500 nM, 50 nM	24 h	WEE1	-	-	CN120548310A	PGDB_A049646	PGDB_C000771	PGDB_AS001655	View
IC50	-	=	1-1.5	uM	-	—	CRBN	CRBN	-	CN120548310A	PGDB_A051170	PGDB_C000771	PGDB_AS000323	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF1	-	-	CN120548310A	PGDB_A061322	PGDB_C000771	PGDB_AS000946	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	GSPT1	-	-	CN120548310A	PGDB_A066152	PGDB_C000771	PGDB_AS001466	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF2	-	-	CN120548310A	PGDB_A068413	PGDB_C000771	PGDB_AS002025	View

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