Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C13H19N |
| Molecular Weight | 189.2967 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCC1=CC=C(C=C1)C2CCNCC2
InChI
InChIKey=NDPOGPAZKKPOPV-UHFFFAOYSA-N
InChI=1S/C13H19N/c1-2-11-3-5-12(6-4-11)13-7-9-14-10-8-13/h3-6,13-14H,2,7-10H2,1H3
| Molecular Formula | C13H19N |
| Molecular Weight | 189.2967 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
CNS Activity
Approval Year
Overview
| CYP3A4 | CYP2C9 | CYP2D6 | hERG |
|---|---|---|---|
OverviewOther
| Other Inhibitor | Other Substrate | Other Inducer |
|---|---|---|
Drug as perpetrator​
| Target | Modality | Activity | Metabolite | Clinical evidence |
|---|---|---|---|---|
Page: 62.0 |
no | |||
Page: 62.0 |
no | |||
Page: 58.0 |
no | |||
Page: 56.0 |
no | |||
Page: 1.0 |
yes [IC50 0.3467 uM] |
Tox targets
| Target | Modality | Activity | Metabolite | Clinical evidence |
|---|---|---|---|---|
Page: 61.0 |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 07:40:12 GMT 2025
by
admin
on
Wed Apr 02 07:40:12 GMT 2025
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| Record UNII |
2JMM46GA2V
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
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Official Name | English | ||
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Preferred Name | English | ||
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Common Name | English |
| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C265
Created by
admin on Wed Apr 02 07:40:12 GMT 2025 , Edited by admin on Wed Apr 02 07:40:12 GMT 2025
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| Code System | Code | Type | Description | ||
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CHEMBL2106188
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100000080228
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SUB06527MIG
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208916
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67765-04-2
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2JMM46GA2V
Created by
admin on Wed Apr 02 07:40:12 GMT 2025 , Edited by admin on Wed Apr 02 07:40:12 GMT 2025
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C72758
Created by
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5835
Created by
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DTXSID8057803
Created by
admin on Wed Apr 02 07:40:12 GMT 2025 , Edited by admin on Wed Apr 02 07:40:12 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |