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Summary Geometry Related PDB entries

A1BZD

Summary

Name:	(morpholin-4-yl)[(4R,8M)-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone
Formula:	C16 H13 F3 N4 O3
Formal charge:	0
Formula weight:	366.295 Da
Component type:	non-polymer

Chemical Identifiers

Program	Version	Name
ACDLabs	14.52	(morpholin-4-yl)[(4R,8M)-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone
OpenEye OEToolkits	3.1.0.0	morpholin-4-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone

Chemical Descriptors

Type	Program	Version	Descriptor
SMILES	ACDLabs	14.52	O=C(c1cnc2c(cc(cn12)C(F)(F)F)c1cnco1)N1CCOCC1
InChI	InChI	1.06	InChI=1S/C16H13F3N4O3/c17-16(18,19)10-5-11(13-7-20-9-26-13)14-21-6-12(23(14)8-10)15(24)22-1-3-25-4-2-22/h5-9H,1-4H2
InChIKey	InChI	1.06	GILHOIQFFNXIHR-UHFFFAOYSA-N
SMILES_CANONICAL	CACTVS	3.385	FC(F)(F)c1cn2c(cnc2c(c1)c3ocnc3)C(=O)N4CCOCC4
SMILES	CACTVS	3.385	FC(F)(F)c1cn2c(cnc2c(c1)c3ocnc3)C(=O)N4CCOCC4
SMILES_CANONICAL	OpenEye OEToolkits	3.1.0.0	c1c(cn2c(cnc2c1c3cnco3)C(=O)N4CCOCC4)C(F)(F)F
SMILES	OpenEye OEToolkits	3.1.0.0	c1c(cn2c(cnc2c1c3cnco3)C(=O)N4CCOCC4)C(F)(F)F

238582

PDB entries from 2025-07-09

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