General Information of the Compound
| Compound ID |
CP0573358
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9163012, 32
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H30N4O3
|
||||||||||||||||||
| Molecular Weight |
422.529
|
||||||||||||||||||
| Canonical SMILES |
Cn1c(nc2ccccc12)C1CCCN1C(=O)OC1C2CC3CC1CC(C3)(C2)C(N)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H30N4O3/c1-27-18-6-3-2-5-17(18)26-21(27)19-7-4-8-28(19)23(30)31-20-15-9-14-10-16(20)13-24(11-14,12-15)22(25)29/h2-3,5-6,14-16,19-20H,4,7-13H2,1H3,(H2,25,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
LHCWBKWHHYSBJC-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