UC1
2-METHYL-FURAN-3-CARBOTHIOIC ACID [4-CHLORO-3-(3-METHYL-BUT-2-ENYLOXY)-PHENYL]-AMIDE
Find entries where: UC1
is present as a standalone ligand in 4 entries
Chemical Component Summary | |
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Name | 2-METHYL-FURAN-3-CARBOTHIOIC ACID [4-CHLORO-3-(3-METHYL-BUT-2-ENYLOXY)-PHENYL]-AMIDE |
Synonyms | UC781 |
Identifiers | N-[4-chloro-3-(3-methylbut-2-enoxy)phenyl]-2-methyl-furan-3-carbothioamide |
Formula | C17 H18 Cl N O2 S |
Molecular Weight | 335.848 |
Type | NON-POLYMER |
Isomeric SMILES | Cc1c(cco1)C(=S)Nc2ccc(c(c2)OCC=C(C)C)Cl |
InChI | InChI=1S/C17H18ClNO2S/c1-11(2)6-8-21-16-10-13(4-5-15(16)18)19-17(22)14-7-9-20-12(14)3/h4-7,9-10H,8H2,1-3H3,(H,19,22) |
InChIKey | YZHIXLCGPOTQNB-UHFFFAOYSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 40 |
Chiral Atom Count | 0 |
Bond Count | 41 |
Aromatic Bond Count | 11 |
Drug Info: DrugBank
DrugBank ID | DB05871 |
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Name | UC-781 |
Groups | investigational |
Description | UC-781 is a thiocarboxanilide non-nucleoside reverse transcriptase inhibitor (NNRTI). It is a topical microbicide targeted against the AIDS virus. |
Synonyms | UC-781 |
Indication | Investigated for use/treatment in HIV infection. |
Categories |
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CAS number | 178870-32-1 |
Drug Targets
Name | Target Sequence | Pharmacological Action | Actions |
---|---|---|---|
Gag-Pol polyprotein | MGARASVLSGGELDRWEKIRLRPGGKKKYKLKHIVWASRELERFAVNPGL... | unknown |
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison
T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS.
Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682
Related Resource References
Resource Name | Reference |
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PubChem | 3000926, 154050 |
ChEMBL | CHEMBL54893 |