PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCC(N2Cc3c(CN4CCC(N5CCC(c6noc7cc(F)ccc67)CC5)C(F)(F)C4)cccc3C2=O)C(=O)N1

Compound summary

Compound IDPGDB_C000874

FormulaC31H32F3N5O4

Molecular weight595.622

InChIKeyPYBSQSAXZSCINC-UHFFFAOYSA-N

Physicochemical properties

Exact mass595.2406

RDKit cLogP3.82

TPSA99

HBD / HBA1 / 7

Rotatable bonds5

Heavy atoms43

Hetero atoms12

Rings / aromatic7 / 3

Fraction Csp30.48

Formal charge0

Fragments1

Activity compounds and values

Activity records

8 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF2	-	-	CN120548310A	PGDB_A007663	PGDB_C000874	PGDB_AS002025	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF3	-	-	CN120548310A	PGDB_A022281	PGDB_C000874	PGDB_AS000102	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF1	-	-	CN120548310A	PGDB_A024116	PGDB_C000874	PGDB_AS000946	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	GSPT1	-	-	CN120548310A	PGDB_A029299	PGDB_C000874	PGDB_AS001466	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	CSNK1A1	-	-	CN120548310A	PGDB_A043300	PGDB_C000874	PGDB_AS001449	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	WEE1	-	-	CN120548310A	PGDB_A051795	PGDB_C000874	PGDB_AS001655	View
% Inhibition	-	=	60-70	%	500 nM	96 h	-	-	MM.1S	CN120548310A	PGDB_A061705	PGDB_C000874	PGDB_AS001316	View
% Inhibition	-	=	32-42	%	10 nM	96 h	-	-	MM.1S	CN120548310A	PGDB_A067587	PGDB_C000874	PGDB_AS000332	View

Rows per pagePage 1 of 1 · 8 recordsGo to page