General Information of the Compound
| Compound ID |
CP0572233
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9428456, 1.171
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H34N4O2
|
||||||||||||||||||
| Molecular Weight |
434.584
|
||||||||||||||||||
| Canonical SMILES |
CC(N1CCC(CC1)C(=O)NC1CCCCC1)c1cccc(NC(=O)c2cccnc2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H34N4O2/c1-19(21-7-5-11-24(17-21)29-26(32)22-8-6-14-27-18-22)30-15-12-20(13-16-30)25(31)28-23-9-3-2-4-10-23/h5-8,11,14,17-20,23H,2-4,9-10,12-13,15-16H2,1H3,(H,28,31)(H,29,32)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZZRJRTXHQWGKPU-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