General Information of the Compound
| Compound ID |
CP0409074
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-[(4-fluorophenyl)methyl]-2-pyridin-2-yl-N-(2-pyrrolidin-1-ylethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H29FN6
|
||||||||||||||||||
| Molecular Weight |
432.547
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccc(CN2CCc3nc(nc(NCCN4CCCC4)c3C2)-c2ccccn2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H29FN6/c26-20-8-6-19(7-9-20)17-32-15-10-22-21(18-32)24(28-12-16-31-13-3-4-14-31)30-25(29-22)23-5-1-2-11-27-23/h1-2,5-9,11H,3-4,10,12-18H2,(H,28,29,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
QGHQEDGPUQFLSH-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