General Information of the Compound
| Compound ID |
CP0384286
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[4-[3-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]butyl]-4-(2-methoxyphenyl)-5,6,7,8-tetrahydropyrido[1,2-c]pyrimidine-1,3-dione
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C33H40N4O4
|
||||||||||||||||||
| Molecular Weight |
556.707
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc2[nH]cc(C3CCCN(CCCCn4c(=O)c(c5CCCCn5c4=O)-c4ccccc4OC)C3)c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C33H40N4O4/c1-40-24-14-15-28-26(20-24)27(21-34-28)23-10-9-17-35(22-23)16-7-8-19-37-32(38)31(25-11-3-4-13-30(25)41-2)29-12-5-6-18-36(29)33(37)39/h3-4,11,13-15,20-21,23,34H,5-10,12,16-19,22H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
FHKKWZHYXCTIQF-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