Compound Detail

CHEMBL303312

Enter ChEMBL ID:

Free Research Context This compound will appear in recent viewed items on the research home for this browser.

C#CCN1CCC2=C(C1)c1c(O)cc(C(C)CCCc3ccc(F)cc3)cc1OC2(C)C

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL303312
Phase	Preclinical
Structure Type	MOL
InChI Key	UIDOJGIFVOOMLY-UHFFFAOYSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

433.6

MW (Da)

5.92

ALogP

HBA

HBD

32.7

PSA (Å²)

0.57

QED

Ro5 Violations

Rot. Bonds

First in Class Prodrug

Ki 1 meas. best 5.49

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Platelet-activating factor receptor CHEMBL5136	Ki	5.49	5.49	3250.0	1

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Platelet-activating factor receptor	Ki	=	3250.0	nM	5.49	In vitro intrinsic binding affinity at platelet activating factor receptor using...	1317924

PubMed	DOI	Target Context	# Activities
6827538	10.1021/jm00356a017	Rattus norvegicus	39
817021	10.1021/jm00226a003	Rattus norvegicus	20
6681843	10.1021/jm00356a031	Rattus norvegicus	8
817021	10.1021/jm00226a003	Felis catus	4
915915	10.1021/jm00221a031	Rattus norvegicus	4
20485427	10.1038/nature09107	Plasmodium falciparum	4
817021	10.1021/jm00226a003	Mus musculus	3
915915	10.1021/jm00221a031	Mus musculus	3
6681843	10.1021/jm00356a031	Mus musculus	3
20485427	10.1038/nature09107	Unchecked	1
20485427	10.1038/nature09107	HepG2	1
817021	10.1021/jm00226a003	Canis familiaris	1
1317924	10.1021/jm00089a016	Platelet-activating factor receptor	1
915915	10.1021/jm00221a031	Canis familiaris	1
915915	10.1021/jm00221a031	Felis catus	1
-	10.6019/CHEMBL3433997	Solute carrier family 2, facilitated glucose transporter member 1	1
-	10.6019/CHEMBL3433997	Hexose transporter 1	1
-	10.6019/CHEMBL3433997	Glucose transporter	1

Data from ChEMBL 36 via Core Engine