General Information of the Compound
| Compound ID |
CP0417884
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
10-Allyl-11-hydroxy-N-propylnoraporphine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H25NO
|
||||||||||||||||||
| Molecular Weight |
319.448
|
||||||||||||||||||
| Canonical SMILES |
CCCN1CCc2cccc-3c2[C@H]1Cc1ccc(CC=C)c(O)c-31
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H25NO/c1-3-6-16-9-10-17-14-19-20-15(11-13-23(19)12-4-2)7-5-8-18(20)21(17)22(16)24/h3,5,7-10,19,24H,1,4,6,11-14H2,2H3/t19-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
WWLWGSVJCNEFEH-LJQANCHMSA-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT01195, D(1A) dopamine receptor
Protein ID: PT01005, D(2) dopamine receptor