Compound Detail

CHEMBL315021

FORASARTAN

🧪 Phase II

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🧪 Phase II

CCCCc1nc(CCCC)n(Cc2ccc(-c3ccccc3-c3nnn[nH]3)nc2)n1

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL315021
Name	FORASARTAN
Phase	Phase II
Structure Type	MOL
InChI Key	YONOBYIBNBCDSJ-UHFFFAOYSA-N

Known Names

Forasartan SC-52458

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

Molecular Properties

416.5

MW (Da)

4.25

ALogP

HBA

HBD

98.1

PSA (Å²)

0.41

QED

Ro5 Violations

Rot. Bonds

Drug Information

Molecule Type	Small molecule
Chirality	Achiral

Flags

Natural Product

USAN Stem	-sartan
USAN Year	1995

Extended Properties

Molecular Formula	C23H28N8
MW	416.53
Aromatic Rings	4
Heavy Atoms	31
NP-Likeness	-1.53

Activity Summary

IC50 6 meas. best 8.55

Kd 4 meas. best 8.2

Target Activity Profile

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Angiotensin II receptor (AT-1) type-1 CHEMBL2094250	IC50	8.55	8.55	2.8	1
Unchecked CHEMBL612545	IC50	8.55	8.55	2.8	1
Type-1 angiotensin II receptor CHEMBL227	Kd	8.2	8.2	6.3	1
Oryctolagus cuniculus CHEMBL374	Kd	8.2	8.2	6.3	1
Angiotensin II receptor CHEMBL2094256	Kd	8.18	8.18	6.6	2
Angiotensin II receptor CHEMBL2094112	IC50	8.16	8.16	6.9	2
Type-1 angiotensin II receptor CHEMBL227	IC50	8.16	8.16	6.9	1
Type-1 angiotensin II receptor B CHEMBL263	IC50	8.16	8.16	6.9	1

Activity Data Samples

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Angiotensin II receptor (AT-1) type-1	IC50	=	2.8	nM	8.55	In vitro antagonistic potency against Angiotensin II receptor, type 1 in rat adr...	8576904
Unchecked	IC50	=	2.8	nM	8.55	Displacement of [125I]-Sar1Ile8-angiotensin 2 from angiotensin AT1 receptor in r...	21071232
Oryctolagus cuniculus	Kd	=	6.31	nM	8.2	Evaluated for antagonism of AII contracted rabbit aortic rings	-
Type-1 angiotensin II receptor	Kd	=	6.31	nM	8.2	Antagonist activity at angiotensin AT1 receptor	21071232
Angiotensin II receptor	Kd	=	6.607	nM	8.18	Inhibition of angiotensin II-induced contractions in rabbit aorta in vitro.	8576904
Angiotensin II receptor	Kd	=	6.607	nM	8.18	Compound was tested for antagonism of Angiotensin II-contracted rabbit aortic ri...	-
Angiotensin II receptor	IC50	=	6.9	nM	8.16	Tested in vitro for inhibition of [125I]AII to rat uterine membranes	-
Type-1 angiotensin II receptor B	IC50	=	6.9	nM	8.16	Binding affinity for rat angiotensin II receptor, type 1	15115399
Angiotensin II receptor	IC50	=	6.9	nM	8.16	Inhibition of [125I]-AII binding to Angiotensin II receptor of rat uterine membr...	-
Type-1 angiotensin II receptor	IC50	=	6.9	nM	8.16	Binding affinity to angiotensin AT1 receptor	21071232

Literature References

PubMed	DOI	Target Context	# Activities
-	10.1016/S0960-894X(00)80286-3	Angiotensin II receptor	2
21071232	10.1016/j.bmc.2010.10.043	Type-1 angiotensin II receptor	2
-	10.1016/S0960-894X(01)81129-X	Angiotensin II receptor	1
-	10.1016/S0960-894X(01)81129-X	Oryctolagus cuniculus	1
15115399	10.1021/jm031100t	Type-1 angiotensin II receptor B	1
8576904	10.1021/jm9504722	Angiotensin II receptor (AT-1) type-1	1
8576904	10.1021/jm9504722	Angiotensin II receptor	1
8576904	10.1021/jm9504722	Canis familiaris	1
21071232	10.1016/j.bmc.2010.10.043	Unchecked	1
21071232	10.1016/j.bmc.2010.10.043	Canis familiaris	1

Data from ChEMBL 36 via Core Engine