Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D04QRS
|
|||
| Former ID |
DNC011654
|
|||
| Drug Name |
PNU-22394
|
|||
| Synonyms |
PNU-22394; CHEMBL6557; 6-methyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole; 6-Methyl-1,2,3,4,5,6-hexahydro-azepino[4,5-b]indole; AC1L1DHJ; SCHEMBL5364550; CHEBI:92297; ZINC2018607; BDBM50130095; BRD-K16551401-003-02-6; BRD-K16551401-003-01-8; 6-methyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indole
Click to Show/Hide
|
|||
| Drug Type |
Small molecular drug
|
|||
| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
 |
Download2D MOL |
||
| Formula |
C13H16N2
|
|||
| Canonical SMILES |
CN1C2=C(CCNCC2)C3=CC=CC=C31
|
|||
| InChI |
1S/C13H16N2/c1-15-12-5-3-2-4-10(12)11-6-8-14-9-7-13(11)15/h2-5,14H,6-9H2,1H3
|
|||
| InChIKey |
ZBXDOQWPGBISAR-UHFFFAOYSA-N
|
|||
| CAS Number |
CAS 15923-78-1
|
|||
| PubChem Compound ID | ||||
| ChEBI ID |
CHEBI:92297
|
|||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | Binding of beta-carbolines at imidazoline I2 receptors: a structure-affinity investigation. Bioorg Med Chem Lett. 2004 Feb 23;14(4):999-1002. | |||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.