Ligand Information
Ligand General Information | Top | |||
---|---|---|---|---|
Ligand ID |
LA6P5D
|
|||
Ligand Name |
N-[3-[(4R)-2-azanyl-4-prop-1-ynyl-5,6-dihydro-1,3-oxazin-4-yl]-4-fluoranyl-phenyl]-5-cyano-pyridine-2-carboxamide
|
|||
Synonyms |
CHEMBL4852444; N-[3-[(4R)-2-azanyl-4-prop-1-ynyl-5,6-dihydro-1,3-oxazin-4-yl]-4-fluoranyl-phenyl]-5-cyano-pyridine-2-carboxamide; SCHEMBL17119107; BDBM50570457; GTU
Click to Show/Hide
|
|||
Structure |
Download2D MOL |
|||
Formula |
C20H16FN5O2
|
|||
Canonical SMILES |
CC#CC1(CCOC(=N1)N)C2=C(C=CC(=C2)NC(=O)C3=NC=C(C=C3)C#N)F
|
|||
InChI |
1S/C20H16FN5O2/c1-2-7-20(8-9-28-19(23)26-20)15-10-14(4-5-16(15)21)25-18(27)17-6-3-13(11-22)12-24-17/h3-6,10,12H,8-9H2,1H3,(H2,23,26)(H,25,27)/t20-/m0/s1
|
|||
InChIKey |
DWCWSXLKLMTBSD-FQEVSTJZSA-N
|
|||
PubChem Compound ID |
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.