L5Y

2-{[2-(1H-pyrazolo[3,4-c]pyridin-3-yl)-6-(trifluoromethyl)pyridin-4-yl]amino}ethanol

Created:2013-10-18
Last modified:  2014-06-18

Help

Find related ligands:

Chemical Details

Formal Charge0
Atom Count35
Chiral Atom Count0
Bond Count37
Aromatic Bond Count16
2D diagram of L5Y

WebGL does not seem to be available.

This can be caused by an outdated browser, graphics card driver issue, or bad weather. Sometimes, just restarting the browser helps. Also, make sure hardware acceleration is enabled in your browser.

For a list of supported browsers, refer to http://caniuse.com/#feat=webgl.

Toggle HydrogenToggle Labels

Chemical Component Summary

Name2-{[2-(1H-pyrazolo[3,4-c]pyridin-3-yl)-6-(trifluoromethyl)pyridin-4-yl]amino}ethanol
Systematic Name (OpenEye OEToolkits)2-[[2-(1H-pyrazolo[3,4-c]pyridin-3-yl)-6-(trifluoromethyl)pyridin-4-yl]amino]ethanol
FormulaC14 H12 F3 N5 O
Molecular Weight323.273
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01FC(F)(F)c3nc(c2nnc1cnccc12)cc(NCCO)c3
SMILESCACTVS3.385OCCNc1cc(nc(c1)C(F)(F)F)c2n[nH]c3cnccc23
SMILESOpenEye OEToolkits1.7.6c1cncc2c1c(n[nH]2)c3cc(cc(n3)C(F)(F)F)NCCO
Canonical SMILESCACTVS3.385 OCCNc1cc(nc(c1)C(F)(F)F)c2n[nH]c3cnccc23
Canonical SMILESOpenEye OEToolkits1.7.6 c1cncc2c1c(n[nH]2)c3cc(cc(n3)C(F)(F)F)NCCO
InChIInChI1.03 InChI=1S/C14H12F3N5O/c15-14(16,17)12-6-8(19-3-4-23)5-10(20-12)13-9-1-2-18-7-11(9)21-22-13/h1-2,5-7,23H,3-4H2,(H,19,20)(H,21,22)
InChIKeyInChI1.03 CNTAIQDCYAEVFL-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 72724831
ChEMBL CHEMBL3099714