Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C13H15ClN4O |
| Molecular Weight | 278.737 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CN1CCN(CC1)C(=O)C2=NC3=C(N2)C=C(Cl)C=C3
InChI
InChIKey=MOIWSUQWIOVGRH-UHFFFAOYSA-N
InChI=1S/C13H15ClN4O/c1-17-4-6-18(7-5-17)13(19)12-15-10-3-2-9(14)8-11(10)16-12/h2-3,8H,4-7H2,1H3,(H,15,16)
| Molecular Formula | C13H15ClN4O |
| Molecular Weight | 278.737 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
Targets
| Primary Target | Pharmacology | Condition | Potency |
|---|---|---|---|
Target ID: CHEMBL3759 Sources: https://www.ncbi.nlm.nih.gov/pubmed/16366610 |
26.0 nM [Ki] | ||
Target ID: CHEMBL264 Sources: https://www.ncbi.nlm.nih.gov/pubmed/16366610 |
14.0 µM [Ki] |
PubMed
| Title | Date | PubMed |
|---|---|---|
| Molecular determinants of ligand binding to H4R species variants. | 2010-05 |
|
| Preparation and biological evaluation of indole, benzimidazole, and thienopyrrole piperazine carboxamides: potent human histamine h(4) antagonists. | 2005-12-29 |
|
| Synthesis and structure-activity relationships of indole and benzimidazole piperazines as histamine H(4) receptor antagonists. | 2004-11-01 |
Patents
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 21:50:29 GMT 2025
by
admin
on
Mon Mar 31 21:50:29 GMT 2025
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| Record UNII |
7EE5T3WL8P
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| Record Status |
Validated (UNII)
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JNJ-10191584
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7EE5T3WL8P
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10446295
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DTXSID801170826
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73903-17-0
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admin on Mon Mar 31 21:50:29 GMT 2025 , Edited by admin on Mon Mar 31 21:50:29 GMT 2025
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| Related Record | Type | Details | ||
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TARGET -> INHIBITOR |
Ki
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ACTIVE MOIETY |