General Information of the Compound
| Compound ID |
CP0550740
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9422293, 313
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H25F6N5O2
|
||||||||||||||||||
| Molecular Weight |
553.507
|
||||||||||||||||||
| Canonical SMILES |
Cc1cc(ccc1Nc1nc(OC2CCOC2)nc2CCN(CCc12)c1ncccc1C(F)(F)F)C(F)(F)F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H25F6N5O2/c1-15-13-16(25(27,28)29)4-5-20(15)34-22-18-6-10-37(23-19(26(30,31)32)3-2-9-33-23)11-7-21(18)35-24(36-22)39-17-8-12-38-14-17/h2-5,9,13,17H,6-8,10-12,14H2,1H3,(H,34,35,36)
Show/Hide
|
||||||||||||||||||
| InChIKey |
LABBHHFMFRFGAC-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: PT01914, Transient receptor potential cation channel subfamily V member 1
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1