Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C23H27N3O6S |
| Molecular Weight | 473.542 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC=CC(OC2=C(OCCO)N=CN=C2NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)=C1
InChI
InChIKey=ZNXOKLWCOWOECF-UHFFFAOYSA-N
InChI=1S/C23H27N3O6S/c1-23(2,3)16-8-10-19(11-9-16)33(28,29)26-21-20(22(25-15-24-21)31-13-12-27)32-18-7-5-6-17(14-18)30-4/h5-11,14-15,27H,12-13H2,1-4H3,(H,24,25,26)
| Molecular Formula | C23H27N3O6S |
| Molecular Weight | 473.542 |
| 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: P25101|||Q16433 Gene ID: 1909.0 Gene Symbol: EDNRA Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/8224248 |
200.0 nM [IC50] | ||
Target ID: P24530|||Q8NHM8 Gene ID: 1910.0 Gene Symbol: EDNRB Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/8224248 |
500.0 nM [IC50] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 05:22:13 GMT 2025
by
admin
on
Wed Apr 02 05:22:13 GMT 2025
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| Record UNII |
96R6F9J2AV
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| Record Status |
Validated (UNII)
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| Record Version |
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DTXSID80164598
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admin on Wed Apr 02 05:22:13 GMT 2025 , Edited by admin on Wed Apr 02 05:22:13 GMT 2025
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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TARGET -> INHIBITOR |
IC50
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TARGET -> INHIBITOR |
human smooth muscle cells
IC50
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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