General Information of the Compound
| Compound ID |
CP0554953
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1,3-dihydroisoindol-2-yl-(2,4-dihydroxy-5-pyrrolo[3,2-b]pyridin-1-ylphenyl)methanone
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H17N3O3
|
||||||||||||||||||
| Molecular Weight |
371.396
|
||||||||||||||||||
| Canonical SMILES |
Oc1cc(O)c(cc1C(=O)N1Cc2ccccc2C1)-n1ccc2ncccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H17N3O3/c26-20-11-21(27)19(25-9-7-17-18(25)6-3-8-23-17)10-16(20)22(28)24-12-14-4-1-2-5-15(14)13-24/h1-11,26-27H,12-13H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
FYCJRTZCIKPOFP-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