PFK

6-methoxy-7-[2-(quinolin-2-yl)ethoxy]quinazoline

Created:	2011-02-15
Last modified:	2011-06-04

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1 entries where PFK is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	42
Chiral Atom Count	0
Bond Count	45
Aromatic Bond Count	22

2D diagram of PFK

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Chemical Component Summary
Name	6-methoxy-7-[2-(quinolin-2-yl)ethoxy]quinazoline
Systematic Name (OpenEye OEToolkits)	6-methoxy-7-(2-quinolin-2-ylethoxy)quinazoline
Formula	C₂₀ H₁₇ N₃ O₂
Molecular Weight	331.368
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	n4c3c(cc(OC)c(OCCc1nc2c(cc1)cccc2)c3)cnc4
SMILES	CACTVS	3.370	COc1cc2cncnc2cc1OCCc3ccc4ccccc4n3
SMILES	OpenEye OEToolkits	1.7.0	COc1cc2cncnc2cc1OCCc3ccc4ccccc4n3
Canonical SMILES	CACTVS	3.370	COc1cc2cncnc2cc1OCCc3ccc4ccccc4n3
Canonical SMILES	OpenEye OEToolkits	1.7.0	COc1cc2cncnc2cc1OCCc3ccc4ccccc4n3
InChI	InChI	1.03	InChI=1S/C20H17N3O2/c1-24-19-10-15-12-21-13-22-18(15)11-20(19)25-9-8-16-7-6-14-4-2-3-5-17(14)23-16/h2-7,10-13H,8-9H2,1H3
InChIKey	InChI	1.03	REIGRVDNVZOVDL-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	24945787
ChEMBL	CHEMBL1738857

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