Structure of ML-193
CAS No.: 713121-80-3
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The BI-3802 was designed by Boehringer Ingelheim and could be obtained free of charge through the Boehringer Ingelheim open innovation portal opnMe.com, associated with its negative control.
ML 193 is a selective GPR55 antagonist with IC50 of 221 nM.
Synonyms: CID 1261822
4.5
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Batch number can be found on the product's label following the word 'Batch'.
Search for reports by entering the product batch number.
Batch number can be found on the product's label following the word 'Batch'.
Search for reports by entering the product batch number.
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CAS No. : | 713121-80-3 |
Formula : | C28H25N5O4S |
M.W : | 527.59 |
SMILES Code : | O=C(C1=CC(C2=NC=CC=C2)=NC3=C(C)C=C(C)C=C13)NC4=CC=C(S(=O)(NC5=C(C)C(C)=NO5)=O)C=C4 |
Synonyms : |
CID 1261822
|
MDL No. : | MFCD05999971 |
InChI Key : | HTSLEZOTMYUPLU-UHFFFAOYSA-N |
Pubchem ID : | 1261822 |
GHS Pictogram: |
![]() |
Signal Word: | Warning |
Hazard Statements: | H302-H315-H319-H335 |
Precautionary Statements: | P261-P280-P301+P312-P302+P352-P305+P351+P338 |
Clinical Trial:
NCT Number | Conditions | Phases | Recruitment | Completion Date | Locations |
NCT01500278 | - | Completed | - | - | |
NCT01500278 | Rheumatoid Arthritis | Phase 4 | Completed | - | - |
NCT00552344 | Crohn Disease | Phase 3 | Completed | - | - |
NCT01887912 | Clostridium Difficile Infectio... More >>n Less << | Phase 3 | Terminated(The Independent Dat... More >>a Monitoring Committee (IDMC) concluded that the probability that the study will meet its primary objective is low.) Less << | - | - |
NCT00552344 | - | Completed | - | - | |
NCT01791114 | Insulin Sensitivity ... More >> Obesity Less << | Not Applicable | Unknown | January 2017 | United States, Texas ... More >> University of Texas Medical Branch at Galveston Recruiting Galveston, Texas, United States, 77555 Contact: Labros Sidossis, PhD 409-266-9690 lasidoss@utmb.edu Principal Investigator: Labros S Sidossis, PhD Less << |
NCT01546909 | Diphtheria Te... More >>tanus Poliomyelitis Less << | Phase 4 | Completed | - | France ... More >> SPMSD Investigational Site 120 Angers, France SPMSD Investigational Site 103 Arras, France SPMSD Investigational Site 155 Asnieres, France SPMSD Investigational Site 125 Bersee, France SPMSD Investigational Site 121 Besancon, France SPMSD Investigational Site 141 Besancon, France SPMSD Investigational Site 124 Blois, France SPMSD Investigational Site 161 Blois, France SPMSD Investigational Site 194 Boulogne Billancourt, France SPMSD Investigational Site 148 Brest, France SPMSD Investigational Site 117 Caen, France SPMSD Investigational Site 147 Caen, France SPMSD Investigational Site 135 Chalons En Champagne, France SPMSD Investigational Site 163 Champdeniers, France SPMSD Investigational Site 145 Chigny Les Roses, France SPMSD Investigational Site 157 Cholet, France SPMSD Investigational Site 101 Clamart, France SPMSD Investigational Site 160 Collombey Les Belles, France SPMSD Investigational Site 162 Collombey Les Belles, France SPMSD Investigational Site 139 DAX, France SPMSD Investigational Site 193 Draguignan, France SPMSD Investigational Site 106 Essey Les Nancy, France SPMSD Investigational Site 123 Essey Les Nancy, France SPMSD Investigational Site 164 Essey Les Nancy, France SPMSD Investigational Site 136 Floirac, France SPMSD Investigational Site 114 Frouard, France SPMSD Investigational Site 150 Haguenau, France SPMSD Investigational Site 113 Illkirch Graffenstaden, France SPMSD Investigational Site 197 Le Havre, France SPMSD Investigational Site 198 Le Havre, France SPMSD Investigational Site 107 Lingolsheim, France SPMSD Investigational Site 115 Louverne, France SPMSD Investigational Site 140 Manduel, France SPMSD Investigational Site 116 Maromme, France SPMSD Investigational Site 153 Marseille, France SPMSD Investigational Site 134 Montpellier, France SPMSD Investigational Site 129 Nogent Sur Marne, France SPMSD Investigational Site 133 Ostwald, France SPMSD Investigational Site 128 Poitiers, France SPMSD Investigational Site 130 Pont A Mousson, France SPMSD Investigational Site 151 Quimper, France SPMSD Investigational Site 102 Rouen, France SPMSD Investigational Site 110 Rouen, France SPMSD Investigational Site 199 Rouen, France SPMSD Investigational Site 152 Saint Ouen, France Less << |
NCT02916628 | Smoking | Not Applicable | Active, not recruiting | June 2019 | Korea, Republic of ... More >> Inha University Hospital Incheon, Korea, Republic of Less << |
NCT00262522 | Human Immunodeficiency Virus I... More >>nfections Less << | Phase 3 | Completed | - | - |
NCT00175877 | Rheumatoid Arthritis | Phase 3 | Completed | - | - |
NCT02928120 | - | Unknown | September 2018 | Denmark ... More >> Department of Gastrointestinal Surgery Recruiting Aalborg, Denmark, 9000 Contact: Simon L Rasmussen, MD 97661763 simon.rasmussen@rn.dk Less << | |
NCT00175877 | - | Completed | - | - | |
NCT03303235 | Uterine Atony ... More >> Uterine Tone Disorders Postpartum Hemorrhage Less << | Early Phase 1 | Not yet recruiting | December 2020 | United States, Maryland ... More >> Johns Hopkins Hospital Not yet recruiting Baltimore, Maryland, United States, 21287 Contact: Karen Lindeman, MD Less << |
NCT02605330 | - | Completed | - | Switzerland ... More >> University Hospital Bern Bern, Switzerland, 3010 Less << | |
NCT01137071 | Fallopian Tube Cancer ... More >> Ovarian Cancer Peritoneal Cavity Cancer Less << | Phase 2 | Terminated(Total number of pts... More >> expected to be enrolled would not be met.) Less << | - | Brazil ... More >> Núcleo de Oncologia da Bahia Salvador, Bahia, Brazil, 40170-110 Cetus Hospital-Dia Oncologia Ltda - Filial Belo Horizonte Belo Horizonte, Minas Gerais, Brazil, 30150-280 Hospital Erasto Gaertner Curitiba, Paraná, Brazil, 81520-060 Hospital de Clínicas de Porto Alegre Porto Alegre, Rio Grande do Sul, Brazil, 90035-903 Hospital de Câncer de Barretos Barretos, São Paulo, Brazil, 14784-700 Fundação Amaral Carvalho Jaú, São Paulo, Brazil, 17210-080 Instituto do Câncer do Estado de São Paulo "Octávio Frias de Oliveira" São Paulo, Brazil, 01246-000 Hospital Israelita Albert Einstein São Paulo, Brazil, 05651-901 Less << |
NCT03651544 | Influenza A Virus Infection ... More >> Influenza A Influenza Epidemic Influenza H5N1 Less << | Phase 1 | Recruiting | April 30, 2019 | Russian Federation ... More >> Federal state budgetary institution " Main military clinical hospital named after academician N. N. Burdenko " of the Ministry of Defence of the Russian Federation Recruiting Moscow, Russian Federation, 141306 Contact: Irina Gagarina, MD Less << |
NCT02812095 | Enterostomy | Not Applicable | Recruiting | December 2018 | Korea, Republic of ... More >> Seoul National University Hospital Recruiting Seoul, Korea, Republic of, 03080 Contact: Seung Han Shin, MD +82220727230 revival421@snu.ac.kr Contact: Ee-Kyung Kim, MD, Ph D +82220723628 kimek@snu.ac.kr Less << |
NCT00262522 | - | Completed | - | - | |
NCT00499239 | Non-Hodgkin's Lymphoma ... More >> Chronic Lymphocytic Leukemia Multiple Myeloma Less << | Phase 1 Phase 2 | Terminated(Unacceptable safety... More >> profile) Less << | - | United States, California ... More >> UCSF San Francisco, California, United States, 94143 United States, Illinois Northwestern University Chicago, Illinois, United States, 60611 United States, Massachusetts Dana Farber Cancer Institute Boston, Massachusetts, United States, 02115 United States, Nevada Nevada Cancer Institute Las Vegas, Nevada, United States, 89135 United States, Texas MD Anderson Cancer Center Houston, Texas, United States, 77303 Czech Republic Fakultni nemocnice Brno - Bohunice Brno, Czech Republic, 625 00 Fakultni nemocnice Hradec Kralove Hradec Kralove, Czech Republic, 500 Fakultni nemocnice Olomouc Olomouc, Czech Republic, 775 20 Fakultni nemocnice Kralovske Vinohrady Praha, Czech Republic, 10 100 34 Vseobecna fakultni nemocnice Praha, Czech Republic, 2 128 08 Russian Federation State Institution: Medical Radiological Research Center under the Russian Academy of Medical Sciences Kaluga Region, Russian Federation, 249036 State institution Main Military Clinical Hospital n.a.academician N.N. Burdenko under the Ministry of Defense of Russia Moscow, Russian Federation, 105229 State Institution Hematological Research Center under the Russian Academy of Medical Sciences Moscow, Russian Federation, 125167 Moscow State Medical Institution: Municipal Clinical Hospital n.a. S.P. Botkin Moscow, Russian Federation, 125284 Non-State Medical Institution Central Clinical Hospital #2 n.a. N.A. Semashko under OJSC "Russian Railways" Moscow, Russian Federation, 129128 State Public Medical Institution of Novosibirsk Region: State Novosibirsk Regional Clinical Hospital Novosibirsk, Russian Federation, 630087 Federal State Institution: Research Institute of Hematology and Blood Transfusion under Federal Agency for High-Tech Medical Care St Petersburg, Russian Federation, 191024 State Higher Educational Institution St. Petersburg State Medical University n.a. I.P. Pavlov under the Federal Agency for Healthcare and Social Development, Institute of Hematology and Transplantology n.a. R.M. Gorbacheva St. Petersburg, Russian Federation, 197022 State Higher Educational Institution St. Petersburg State Medical University n.a. I.P. Pavlov under the Federal Agency for Healthcare and Social Development St. Petersburg, Russian Federation, 197022 Federal State Institution Russian Research Center of Radiology and Surgical Technologies under the Federal Agency for High-Tech Medical Care St. Petersburg, Russian Federation, 197758 Less << |
NCT00617773 | Fallopian Tube Cancer ... More >> Ovarian Cancer Primary Peritoneal Cancer Less << | Phase 2 | Completed | - | Brazil ... More >> Hospital de Clinicas de Porto Alegre Porto Alegre, Rio Grande do Sul, Brazil, 90035-903 Hospital da Baleia Minas Gerais, Brazil, 30285-000 Hospital Sao Lucas da PUCRS Porto Alegre, Brazil, 90610-000 Instituto Nacional de Cancer Rio de Janeiro, Brazil, 20220-410 Hospital das Clinicas FMUSP Sao Paulo, Brazil, 01246-000 Hospital Sirio-Libanes Sao Paulo, Brazil, 01308-050 Hospital Alemao Oswaldo Cruz Sao Paulo, Brazil, 01401-904 Hospital Israelita Albert Einstein Sao Paulo, Brazil, 05651-901 Less << |
NCT01734265 | Allergy Rhini... More >>tis Rhinoconjunctivitis Seasonal Asthma Less << | Phase 2 | Completed | - | Spain ... More >> H. Manresa Manresa, Barcelona, Spain, 08243 H. Luis Alcañiz Xativa, Valencia, Spain, 46800 H. Virgen Macarena Sevilla, Spain, 41009 H. Virgen del Rocío Sevilla, Spain, 41013 Less << |
NCT01370239 | Breast Cancer | Phase 2 | Suspended(futility) | November 2018 | Brazil ... More >> Universidade Federal Do Ceará Fortaleza, Ceará, Brazil PONTIFíCIA UNIVERSIDADE CATÓLICA DO RIO GRANDE DO SUL Porto Alegre, RIO Grande DO SUL, Brazil Hospital Do Câncer de Barretos Barretos, SÃO Paulo, Brazil Universidade Federal de Goias Goias, Brazil Instituto Nacional Do Câncer Rio de Janeiro, Brazil Instituto Do Câncer Do Estado de São Paulo Sao Paulo, Brazil, 01246-000 Hospital Sirio Libanes Sao Paulo, Brazil Less << |
NCT01137071 | - | Terminated(Total number of pts... More >> expected to be enrolled would not be met.) Less << | - | - | |
NCT00617773 | - | Completed | - | - |
Bio Calculators | ||||
Preparing Stock Solutions | ![]() |
1mg | 5mg | 10mg |
1 mM 5 mM 10 mM |
1.90mL 0.38mL 0.19mL |
9.48mL 1.90mL 0.95mL |
18.95mL 3.79mL 1.90mL |
Tags: ML-193 | CID 1261822 | Amides | GPCR | Organic Building Blocks | Parkinson'S Disease and Alzheimer'S Disease | GPCR/G Protein | 713121-80-3
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P340 | Remove victim to fresh air and keep at rest in a position comfortable for breathing. |
P341 | If breathing is difficult, remove victim to fresh air and keep at rest in a position comfortable for breathing. |
P342 | If experiencing respiratory symptoms: |
P350 | Gently wash with plenty of soap and water. |
P351 | Rinse cautiously with water for several minutes. |
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P378 | |
P380 | Evacuate area. |
P381 | Eliminate all ignition sources if safe to do so. |
P390 | Absorb spillage to prevent material damage. |
P391 | Collect spillage. Hazardous to the aquatic environment |
P301 + P310 | IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician. |
P301 + P312 | IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. |
P301 + P330 + P331 | IF SWALLOWED: Rinse mouth. Do NOT induce vomiting. |
P302 + P334 | IF ON SKIN: Immerse in cool water/wrap in wet bandages. |
P302 + P350 | IF ON SKIN: Gently wash with plenty of soap and water. |
P303 + P361 + P353 | IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower. |
P304 + P312 | IF INHALED: Call a POISON CENTER or doctor/physician if you feel unwell. |
P304 + P340 | IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing. |
P304 + P341 | IF INHALED: If breathing is difficult, remove victim to fresh air and keep at rest in a position comfortable for breathing. |
P305 + P351 + P338 | IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. |
P306 + P360 | IF ON CLOTHING: Rinse Immediately contaminated CLOTHING and SKIN with plenty of water before removing clothes. |
P307 + P311 | IF exposed: call a POISON CENTER or doctor/physician. |
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P309 + P311 | IF exposed or if you feel unwell: call a POISON CENTER or doctor/physician. |
P332 + P313 | IF SKIN irritation occurs: Get medical advice/attention. |
P333 + P313 | IF SKIN irritation or rash occurs: Get medical advice/attention. |
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P337 + P313 | IF eye irritation persists: Get medical advice/attention. |
P342 + P311 | IF experiencing respiratory symptoms: call a POISON CENTER or doctor/physician. |
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H200 | Unstable explosive |
H201 | Explosive; mass explosion hazard |
H202 | Explosive; severe projection hazard |
H203 | Explosive; fire, blast or projection hazard |
H204 | Fire or projection hazard |
H205 | May mass explode in fire |
H220 | Extremely flammable gas |
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H231 | May react explosively even in the absence of air at elevated pressure and/or temperature |
H240 | Heating may cause an explosion |
H241 | Heating may cause a fire or explosion |
H242 | Heating may cause a fire |
H250 | Catches fire spontaneously if exposed to air |
H251 | Self-heating; may catch fire |
H252 | Self-heating in large quantities; may catch fire |
H260 | In contact with water releases flammable gases which may ignite spontaneously |
H261 | In contact with water releases flammable gas |
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H272 | May intensify fire; oxidizer |
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H290 | May be corrosive to metals |
Health hazards | |
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H300 | Fatal if swallowed |
H301 | Toxic if swallowed |
H302 | Harmful if swallowed |
H303 | May be harmful if swallowed |
H304 | May be fatal if swallowed and enters airways |
H305 | May be harmful if swallowed and enters airways |
H310 | Fatal in contact with skin |
H311 | Toxic in contact with skin |
H312 | Harmful in contact with skin |
H313 | May be harmful in contact with skin |
H314 | Causes severe skin burns and eye damage |
H315 | Causes skin irritation |
H316 | Causes mild skin irritation |
H317 | May cause an allergic skin reaction |
H318 | Causes serious eye damage |
H319 | Causes serious eye irritation |
H320 | Causes eye irritation |
H330 | Fatal if inhaled |
H331 | Toxic if inhaled |
H332 | Harmful if inhaled |
H333 | May be harmful if inhaled |
H334 | May cause allergy or asthma symptoms or breathing difficulties if inhaled |
H335 | May cause respiratory irritation |
H336 | May cause drowsiness or dizziness |
H340 | May cause genetic defects |
H341 | Suspected of causing genetic defects |
H350 | May cause cancer |
H351 | Suspected of causing cancer |
H360 | May damage fertility or the unborn child |
H361 | Suspected of damaging fertility or the unborn child |
H361d | Suspected of damaging the unborn child |
H362 | May cause harm to breast-fed children |
H370 | Causes damage to organs |
H371 | May cause damage to organs |
H372 | Causes damage to organs through prolonged or repeated exposure |
H373 | May cause damage to organs through prolonged or repeated exposure |
Environmental hazards | |
Code | Phrase |
H400 | Very toxic to aquatic life |
H401 | Toxic to aquatic life |
H402 | Harmful to aquatic life |
H410 | Very toxic to aquatic life with long-lasting effects |
H411 | Toxic to aquatic life with long-lasting effects |
H412 | Harmful to aquatic life with long-lasting effects |
H413 | May cause long-lasting harmful effects to aquatic life |
H420 | Harms public health and the environment by destroying ozone in the upper atmosphere |
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