General Information of the Compound
| Compound ID |
CP0431271
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
methyl 2-[1'-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-oxospiro[indole-3,4'-piperidine]-1-yl]acetate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H34N2O3
|
||||||||||||||||||
| Molecular Weight |
410.558
|
||||||||||||||||||
| Canonical SMILES |
COC(=O)CN1C(=O)C2(CCN(CC2)C2CCC3CCCCC3C2)c2ccccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H34N2O3/c1-30-23(28)17-27-22-9-5-4-8-21(22)25(24(27)29)12-14-26(15-13-25)20-11-10-18-6-2-3-7-19(18)16-20/h4-5,8-9,18-20H,2-3,6-7,10-17H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
GSLPZHCOJZRJIT-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