General Information of the Compound
| Compound ID |
CP0492902
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9422293, 31
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H27ClN6
|
||||||||||||||||||
| Molecular Weight |
422.964
|
||||||||||||||||||
| Canonical SMILES |
Cc1c(Cl)ncnc1N1CCc2ncnc(Nc3ccc(cc3)C(C)(C)C)c2CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H27ClN6/c1-15-20(24)26-14-28-22(15)30-11-9-18-19(10-12-30)25-13-27-21(18)29-17-7-5-16(6-8-17)23(2,3)4/h5-8,13-14H,9-12H2,1-4H3,(H,25,27,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
YSARDZCQWSGVAK-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
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1
Protein ID: PT01914, Transient receptor potential cation channel subfamily V member 1