A-278637

FC1=CC=C(C=C1Br)[C@@H]2C3=C(CCS3(=O)=O)NC4=C2C(=O)CCC4

InChIKey=LHVKVMMIMWOYFR-HNNXBMFYSA-N

InChI=1S/C17H15BrFNO3S/c18-10-8-9(4-5-11(10)19)15-16-12(2-1-3-14(16)21)20-13-6-7-24(22,23)17(13)15/h4-5,8,15,20H,1-3,6-7H2/t15-/m0/s1

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Targets

Primary Target	Pharmacology	Potency
Vasopressin V1a receptor 17 Target ID: CHEMBL1889 Sources: https://www.ncbi.nlm.nih.gov/pubmed/12235274	Antagonist 2778	0.92 µM [Ki]
Voltage-gated potassium channel subunit Kv1.5 37 Target ID: CHEMBL4306 Sources: https://www.ncbi.nlm.nih.gov/pubmed/12235274	Inhibitor 8297
Voltage-gated L-type calcium channel 92 Target ID: CHEMBL2095229 Sources: https://www.ncbi.nlm.nih.gov/pubmed/12235274	Inhibitor 8297
HERG 92 Target ID: CHEMBL240 Sources: https://www.ncbi.nlm.nih.gov/pubmed/12235274	Inhibitor 8297
Calcium-activated potassium channel alpha/beta 1 5 Target ID: CHEMBL3038495 Sources: https://www.ncbi.nlm.nih.gov/pubmed/12235274	Activator 1430
Inward rectifier potassium channel 4 1 Target ID: CHEMBL2146347 Sources: https://www.ncbi.nlm.nih.gov/pubmed/12235274	Inhibitor 8297
Voltage-gated potassium channel 16 Target ID: CHEMBL2362996 Sources: https://www.ncbi.nlm.nih.gov/pubmed/12235274	Opener 34	5.52 null [pEC50]

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:30:13 GMT 2023` Edited by `admin` on `Fri Dec 15 16:30:13 GMT 2023`
Record UNII	TM1S7YDA00
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

A-278637

Common Name

English

THIENO(3,2-B)QUINOLIN-8(4H)-ONE, 9-(3-BROMO-4-FLUOROPHENYL)-2,3,5,6,7,9-HEXAHYDRO-, 1,1-DIOXIDE, (9S)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

9887869

Created by admin on Fri Dec 15 16:30:13 GMT 2023 , Edited by admin on Fri Dec 15 16:30:13 GMT 2023

PRIMARY

CAS

227609-66-7

Created by admin on Fri Dec 15 16:30:13 GMT 2023 , Edited by admin on Fri Dec 15 16:30:13 GMT 2023

PRIMARY

FDA UNII

TM1S7YDA00

Created by admin on Fri Dec 15 16:30:13 GMT 2023 , Edited by admin on Fri Dec 15 16:30:13 GMT 2023

PRIMARY

Related Record Type Details


					TM1S7YDA00

A-278637

ACTIVE MOIETY