Details
Stereochemistry | ACHIRAL |
Molecular Formula | C36H45N5O5S |
Molecular Weight | 659.838 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CCCCC1=NC2(CCCC2)C(=O)N1CC3=CC=C(C(CN4CCC(C)(C)C4=O)=C3)C5=CC=CC=C5S(=O)(=O)NC6=C(C)C(C)=NO6
InChI
InChIKey=NBDFXMDYBLSGLX-UHFFFAOYSA-N
InChI=1S/C36H45N5O5S/c1-6-7-14-31-37-36(17-10-11-18-36)34(43)41(31)22-26-15-16-28(27(21-26)23-40-20-19-35(4,5)33(40)42)29-12-8-9-13-30(29)47(44,45)39-32-24(2)25(3)38-46-32/h8-9,12-13,15-16,21,39H,6-7,10-11,14,17-20,22-23H2,1-5H3
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: CHEMBL227 Sources: https://www.ncbi.nlm.nih.gov/pubmed/12190306 |
10.0 nM [Ki] | ||
Target ID: P25101|||Q16433 Gene ID: 1909.0 Gene Symbol: EDNRA Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/12190306 |
1.9 nM [Ki] |
Name | Type | Language | ||
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Code System | Code | Type | Description | ||
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254737-87-6
Created by
admin on Sat Dec 16 09:27:37 GMT 2023 , Edited by admin on Sat Dec 16 09:27:37 GMT 2023
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PRIMARY | |||
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9895957
Created by
admin on Sat Dec 16 09:27:37 GMT 2023 , Edited by admin on Sat Dec 16 09:27:37 GMT 2023
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EEP77N970Y
Created by
admin on Sat Dec 16 09:27:37 GMT 2023 , Edited by admin on Sat Dec 16 09:27:37 GMT 2023
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PRIMARY |
ACTIVE MOIETY