Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D0ZL2A
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| Former ID |
DIB020424
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| Drug Name |
MRS1523
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| Synonyms |
MRS 1523 ; MRS-1523
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL
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| Formula |
C23H29NO3S
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| Canonical SMILES |
CCCC1=C(C(=NC(=C1C(=O)SCC)CC)C2=CC=CC=C2)C(=O)OCCC
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| InChI |
1S/C23H29NO3S/c1-5-12-17-19(23(26)28-8-4)18(7-3)24-21(16-13-10-9-11-14-16)20(17)22(25)27-15-6-2/h9-11,13-14H,5-8,12,15H2,1-4H3
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| InChIKey |
UUSHFEVEROROSP-UHFFFAOYSA-N
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| CAS Number |
CAS 212329-37-8
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| PubChem Compound ID | ||||
| PubChem Substance ID |
4997151, 7980038, 9831048, 11111434, 14830456, 17405344, 24278127, 37856319, 47424236, 50106609, 50106610, 53777889, 56463618, 57356468, 78734149, 85209691, 85231127, 90341403, 92098501, 92304078, 103329922, 103967442, 112060444, 121361692, 124749996, 124800903, 124880654, 126261098, 129423418, 135650652, 162228389, 163122841, 163564737, 170474555, 178127095, 179235821, 204366635, 232101073, 252160708
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| References | Top | |||
|---|---|---|---|---|
| REF 1 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 474). | |||
| REF 2 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Target id: 18). | |||
| REF 3 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Target id: 20). | |||
| REF 4 | Structure-activity relationships and molecular modeling of 3, 5-diacyl-2,4-dialkylpyridine derivatives as selective A3 adenosine receptor antagonists. J Med Chem. 1998 Aug 13;41(17):3186-201. | |||
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