General Information of the Compound
| Compound ID |
CP0922097
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl)(2-(pyridin-4-yl)pyrrolidin-1-yl)methanone
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H21Cl2N5O
|
||||||||||||||||||
| Molecular Weight |
454.361
|
||||||||||||||||||
| Canonical SMILES |
CC1=C(C(=O)N2CCCC2c2ccncc2)C(c2ccc(Cl)c(Cl)c2)n2nccc2N1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H21Cl2N5O/c1-14-21(23(31)29-12-2-3-19(29)15-6-9-26-10-7-15)22(30-20(28-14)8-11-27-30)16-4-5-17(24)18(25)13-16/h4-11,13,19,22,28H,2-3,12H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
MXWZXJYXUPDICA-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