F4Z

3,5,6-trichloro-2-pyridinol

Created:	2018-05-31
Last modified:	2018-07-11

Find Related PDB Entry
2 entries where F4Z is found as a standalone ligand

Find related ligands:

Similar Ligands (Stereospecific) Similar Ligands (including Stereoisomers) Similar Ligands (Quick Screen) Similar Ligands (Substructure Stereospecific) Similar Ligands (Substructure including Stereoisomers)

Chemical Details
Formal Charge	0
Atom Count	12
Chiral Atom Count	0
Bond Count	12
Aromatic Bond Count	6

2D diagram of F4Z

Toggle Hydrogen Toggle Labels

Chemical Component Summary
Name	3,5,6-trichloro-2-pyridinol
Systematic Name (OpenEye OEToolkits)	3,5,6-tris(chloranyl)pyridin-2-ol
Formula	C₅ H₂ Cl₃ N O
Molecular Weight	198.434
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Oc1nc(Cl)c(Cl)cc1Cl
SMILES	OpenEye OEToolkits	2.0.6	c1c(c(nc(c1Cl)Cl)O)Cl
Canonical SMILES	CACTVS	3.385	Oc1nc(Cl)c(Cl)cc1Cl
Canonical SMILES	OpenEye OEToolkits	2.0.6	c1c(c(nc(c1Cl)Cl)O)Cl
InChI	InChI	1.03	InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)
InChIKey	InChI	1.03	WCYYAQFQZQEUEN-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	23017
ChEMBL	CHEMBL3186214
ChEBI	CHEBI:143794, CHEBI:83490
CCDC/CSD	OGEZIJ, OGEZOP

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.