IBD Research Resource Center

BioID	bio2393
Name	XYLAZINE
ChEMBL ID	CHEMBL297362
Molecular Formula	C12H16N2S
Molecular Weight	220.34
Molecular Weight (Monoisotopic)	220.1034
Type	Small molecule
Max Phase	Phase 2
Target ID	Tar12
Target Name	Toll-like receptor 9 (TLR9)
Synonyms	CHANAZINE\|NSC-758142\|XILAZINA\|XYLAZINE\|Xylazine
Smiles	Cc1cccc(C)c1NC1=NCCCS1
Inchi	InChI=1S/C12H16N2S/c1-9-5-3-6-10(2)11(9)14-12-13-7-4-8-15-12/h3,5-6H,4,7-8H2,1-2H3,(H,13,14)
Inchi Key	BPICBUSOMSTKRF-UHFFFAOYSA-N
Molecular Species	NEUTRAL
Targets	31.0
Bioactivities	63.0
Np Likeness Score	-1.19
Records Key	['14 (Xylazine)', 'SID11111970', '14 (xylazine)', '29 (Xylazine)', 'SID3712514', 'XYLAZINE', 'SID144203854', 'SID26747186', 'SID26752277', 'SID11111971', 'Xylazine', 'XYLAZINE', 'SID170466147', 'XYLAZINE', 'SID104171265', 'SID90341260', 'XYLAZINE', 'Xylazine', 'XYLAZINE', 'SID124881828', 'XYLAZINE HYDROCHLORIDE', 'XYLAZINE HYDROCHLORIDE', 'XYLAZINE', 'COVC-0678143036', 'BA1000705']
Records Name	['(2,6-Dimethyl-phenyl)-[1,3]thiazinan-2-ylidene-amine', 'SID11111970', '(5,6-Dihydro-4H-[1,3]thiazin-2-yl)-(2,6-dimethyl-phenyl)-amine', '(5,6-Dihydro-4H-[1,3]thiazin-2-yl)-(2,6-dimethyl-phenyl)-amine', 'SID3712514', 'XYLAZINE', 'SID144203854', 'SID26747186', 'SID26752277', 'SID11111971', 'Xylazine', 'XYLAZINE', 'SID170466147', 'XYLAZINE', 'SID104171265', 'SID90341260', 'XYLAZINE', 'Xylazine', 'XYLAZINE', 'SID124881828', 'XYLAZINE HYDROCHLORIDE', 'XYLAZINE HYDROCHLORIDE', 'XYLAZINE', 'XYLAZINE', 'XYLAZINE']
Withdrawn Flag	False
Orphan	0