General Information of the Compound
| Compound ID |
CP0464005
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
9H-carbazol-2-yl N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]carbamate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H32N4O3
|
||||||||||||||||||
| Molecular Weight |
472.589
|
||||||||||||||||||
| Canonical SMILES |
COc1ccccc1N1CCN(CCCCNC(=O)Oc2ccc3c(c2)[nH]c2ccccc32)CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H32N4O3/c1-34-27-11-5-4-10-26(27)32-18-16-31(17-19-32)15-7-6-14-29-28(33)35-21-12-13-23-22-8-2-3-9-24(22)30-25(23)20-21/h2-5,8-13,20,30H,6-7,14-19H2,1H3,(H,29,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
VCYGJFJKSCACCN-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
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor