General Information of the Compound
| Compound ID |
CP0365701
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[3-[(3R)-5-amino-3-methyl-2,6-dihydro-1,4-oxazin-3-yl]-4-fluorophenyl]pyrimidine-5-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H16FN5O2
|
||||||||||||||||||
| Molecular Weight |
329.335
|
||||||||||||||||||
| Canonical SMILES |
C[C@]1(COCC(N)=N1)c1cc(NC(=O)c2cncnc2)ccc1F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H16FN5O2/c1-16(8-24-7-14(18)22-16)12-4-11(2-3-13(12)17)21-15(23)10-5-19-9-20-6-10/h2-6,9H,7-8H2,1H3,(H2,18,22)(H,21,23)/t16-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
YFTVSHJEIOBWOX-INIZCTEOSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound