General Information of the Compound
| Compound ID |
CP0190276
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
[3-[[methyl-[5-[(6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]pentyl]amino]methyl]phenyl] N-heptylcarbamate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C34H46N2O5
|
||||||||||||||||||
| Molecular Weight |
562.751
|
||||||||||||||||||
| Canonical SMILES |
CCCCCCCNC(=O)Oc1cccc(CN(C)CCCCCOc2ccc3c4CCCCc4c(=O)oc3c2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C34H46N2O5/c1-3-4-5-6-10-20-35-34(38)40-28-15-13-14-26(23-28)25-36(2)21-11-7-12-22-39-27-18-19-30-29-16-8-9-17-31(29)33(37)41-32(30)24-27/h13-15,18-19,23-24H,3-12,16-17,20-22,25H2,1-2H3,(H,35,38)
Show/Hide
|
||||||||||||||||||
| InChIKey |
XFLYZTYNYBFURZ-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