General Information of the Compound
Compound ID |
CP0172895
|
||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Compound Name |
(S)-1-(1H-pyrrolo[2,3-f]quinolin-1-yl)propan-2-amine
Show/Hide
|
||||||||||||||||||
Synonyms |
(S)-1-(1H-pyrrolo[2,3-f]quinolin-1-yl)-2-propylamine
BDBM50176272
CHEMBL201930
SCHEMBL6605040
SDEXYLCQNBTWLI-JTQLQIEISA-N
VER-2692
Show/Hide
|
||||||||||||||||||
Structure |
|
||||||||||||||||||
Formula |
C14H15N3
|
||||||||||||||||||
Molecular Weight |
225.295
|
||||||||||||||||||
Canonical SMILES |
C[C@H](N)Cn1ccc2ccc3ncccc3c12
Show/Hide
|
||||||||||||||||||
InChI |
InChI=1S/C14H15N3/c1-10(15)9-17-8-6-11-4-5-13-12(14(11)17)3-2-7-16-13/h2-8,10H,9,15H2,1H3/t10-/m0/s1
Show/Hide
|
||||||||||||||||||
InChIKey |
SDEXYLCQNBTWLI-JTQLQIEISA-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT01019, 5-hydroxytryptamine receptor 2B
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C
Clinical Information about the Compound