SWX

(4-pyrimidin-5-ylphenyl)methanol

Created: 2016-05-05
Last modified:  2016-08-03

Find related ligands:

Chemical Details

Formal Charge0
Atom Count24
Chiral Atom Count0
Bond Count25
Aromatic Bond Count12
2D diagram of SWX

Chemical Component Summary

Name(4-pyrimidin-5-ylphenyl)methanol
Systematic Name (OpenEye OEToolkits)(4-pyrimidin-5-ylphenyl)methanol
FormulaC11 H10 N2 O
Molecular Weight186.21
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385OCc1ccc(cc1)c2cncnc2
SMILESOpenEye OEToolkits2.0.5c1cc(ccc1CO)c2cncnc2
Canonical SMILESCACTVS3.385 OCc1ccc(cc1)c2cncnc2
Canonical SMILESOpenEye OEToolkits2.0.5 c1cc(ccc1CO)c2cncnc2
InChIInChI1.03 InChI=1S/C11H10N2O/c14-7-9-1-3-10(4-2-9)11-5-12-8-13-6-11/h1-6,8,14H,7H2
InChIKeyInChI1.03 QPOIDCHBWLGFGU-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 7162046