1ZQ

5,6-bis(4-fluorophenyl)pyridine-2,3-diol

Created:	2013-08-12
Last modified:	2013-09-18

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1 entries where 1ZQ is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	33
Chiral Atom Count	0
Bond Count	35
Aromatic Bond Count	18

2D diagram of 1ZQ

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Chemical Component Summary
Name	5,6-bis(4-fluorophenyl)pyridine-2,3-diol
Systematic Name (OpenEye OEToolkits)	5,6-bis(4-fluorophenyl)pyridine-2,3-diol
Formula	C₁₇ H₁₁ F₂ N O₂
Molecular Weight	299.272
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	Fc3ccc(c2nc(O)c(O)cc2c1ccc(F)cc1)cc3
SMILES	CACTVS	3.385	Oc1cc(c2ccc(F)cc2)c(nc1O)c3ccc(F)cc3
SMILES	OpenEye OEToolkits	1.7.6	c1cc(ccc1c2cc(c(nc2c3ccc(cc3)F)O)O)F
Canonical SMILES	CACTVS	3.385	Oc1cc(c2ccc(F)cc2)c(nc1O)c3ccc(F)cc3
Canonical SMILES	OpenEye OEToolkits	1.7.6	c1cc(ccc1c2cc(c(nc2c3ccc(cc3)F)O)O)F
InChI	InChI	1.03	InChI=1S/C17H11F2NO2/c18-12-5-1-10(2-6-12)14-9-15(21)17(22)20-16(14)11-3-7-13(19)8-4-11/h1-9,21H,(H,20,22)
InChIKey	InChI	1.03	CIZBXDSIEHHRKM-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	71710917
ChEMBL	CHEMBL2443233

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