Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D08GRY
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| Former ID |
DNC001576
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| Drug Name |
DUP 697
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| Synonyms |
Dup 697; dup-697; 88149-94-4; MRWLZPOFPA; UNII-MRWLZPOFPA; CHEMBL42485; CHEBI:4720; 5-Bromo-2-(4-fluorophenyl)-3-(4-methysulfonylphenyl)thiophene; 5-bromo-2-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)thiophene; CPD000466299; Thiophene, 5-bromo-2-(4-fluorophenyl)-3-(4-(methylsulfonyl)phenyl)-; Thiophene, 5-bromo-2-(4-fluorophenyl)-3-[4-(methylsulfonyl)phenyl]- [CAS]; 5-bromo-2-(4-fluorophenyl)-3-[4-(methylsulfonyl)phenyl]thiophene; 5-Bromo-2-(4-fluorophenyl)-3-(4-(methylsulfonyl)phenyl)thiophene; SMR000466299
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| Drug Type |
Small molecular drug
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| Indication | Pain [ICD-11: MG30-MG3Z] | Discontinued in Phase 1 | [1] | |
| Therapeutic Class |
Analgesics
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| Structure |
 |
Download2D MOL |
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| Formula |
C17H12BrFO2S2
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| Canonical SMILES |
CS(=O)(=O)C1=CC=C(C=C1)C2=C(SC(=C2)Br)C3=CC=C(C=C3)F
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| InChI |
1S/C17H12BrFO2S2/c1-23(20,21)14-8-4-11(5-9-14)15-10-16(18)22-17(15)12-2-6-13(19)7-3-12/h2-10H,1H3
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| InChIKey |
AJFTZWGGHJXZOB-UHFFFAOYSA-N
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| CAS Number |
CAS 88149-94-4
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| PubChem Compound ID | ||||
| PubChem Substance ID |
13869, 7726235, 8152024, 11114082, 14928864, 26719806, 29222319, 46387010, 49681791, 50053834, 57309595, 57321650, 68530662, 80761432, 85788656, 91746500, 92308584, 103136645, 103223949, 103938661, 104302750, 117390457, 124659165, 124800237, 125334692, 127414638, 134339975, 135093630, 135698419, 137124599, 142359440, 162022338, 162022948, 162927750, 172080565, 172848190, 179148531, 184600222, 221672815, 223439577, 223509535, 225006616, 227291251, 241182424, 241375426, 252457472
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| ChEBI ID |
CHEBI:4720
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| References | Top | |||
|---|---|---|---|---|
| REF 1 | Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800000951) | |||
| REF 2 | Current status of COX-2 inhibitors. Mini Rev Med Chem. 2008 Jan;8(1):73-90. | |||
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