General Information of the Compound
| Compound ID |
CP0391665
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-N-[(3-fluorophenyl)methyl]-6-[3-(methylamino)azetidin-1-yl]pyrimidine-2,4-diamine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C15H19FN6
|
||||||||||||||||||
| Molecular Weight |
302.357
|
||||||||||||||||||
| Canonical SMILES |
CNC1CN(C1)c1cc(NCc2cccc(F)c2)nc(N)n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H19FN6/c1-18-12-8-22(9-12)14-6-13(20-15(17)21-14)19-7-10-3-2-4-11(16)5-10/h2-6,12,18H,7-9H2,1H3,(H3,17,19,20,21)
Show/Hide
|
||||||||||||||||||
| InChIKey |
FYTAYYAHRNTWSO-UHFFFAOYSA-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