General Information of the Compound
| Compound ID |
CP0470466
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(3-methyl-1H-indazole-5-carbonyl)spiro[piperidine-4,2'-pyrano[3,2-b]pyridin]-4'(3'H)-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H20N4O3
|
||||||||||||||||||
| Molecular Weight |
376.416
|
||||||||||||||||||
| Canonical SMILES |
Cc1n[nH]c2ccc(cc12)C(=O)N1CCC2(CC1)CC(=O)c1ncccc1O2
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H20N4O3/c1-13-15-11-14(4-5-16(15)24-23-13)20(27)25-9-6-21(7-10-25)12-17(26)19-18(28-21)3-2-8-22-19/h2-5,8,11H,6-7,9-10,12H2,1H3,(H,23,24)
Show/Hide
|
||||||||||||||||||
| InChIKey |
AWDUCGUPVPPYFH-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