General Information of the Compound
| Compound ID |
CP0337967
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-(4-methoxyphenyl)-1'-methylspiro[5,13,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H24N4O2
|
||||||||||||||||||
| Molecular Weight |
400.482
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cc1)-c1cc2-c3[nH]c4c(c3CCc2cn1)C(=O)NCC41CN(C)C1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H24N4O2/c1-28-12-24(13-28)11-26-23(29)20-17-8-5-15-10-25-19(9-18(15)21(17)27-22(20)24)14-3-6-16(30-2)7-4-14/h3-4,6-7,9-10,27H,5,8,11-13H2,1-2H3,(H,26,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
KQIODUAXCRMNES-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