Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5746531107
Compound
Show structures
In order to add this molecule to a collection you have to create an account.
Sign up for free
- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 5 USD | 98 | 16 working days | Get Quote |
| 5 mg | 5 USD | 98 | 16 working days | Get Quote |
| 10 mg | 5 USD | 98 | 16 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
-
MCULE-3182061888
- Component type: Main
-
MCULE-2062191384
- Component type: Main
-
MCULE-3164242046
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5746531107.sdf |
| SMILES | MCULE-5746531107.smiles |
| Standard InChI | MCULE-5746531107.inchi |
| InChIKey | MCULE-5746531107.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867662690 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875831788 | AA Blocks | AA Blocks | N/A | As is | in stock |
| P-869184116 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505354573 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-505389332 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-596973199 | Angene | Building Blocks in stock | 98 | As is | 500 g |
| P-872723395 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-864142014 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580710257 | BLD pharm | In-stock building blocks | 98 | As is | unavailable |
| P-505573130 | Bosche Scientific | Bosche Products | 98 | As is | in stock |
| P-674256333 | ChemDiv | Discovery Chemistry Library | 90 | As is | 40 mg |
| P-851266932 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-500143791 | Chemtos | In-stock Products | 95 | As is | in stock |
| P-580451992 | CliniSciences S.A.S | All products | 99 | As is | in stock |
| P-666730511 | Eximed | In-stock screening compounds | 90 | As is | 300 mg |
| P-500417867 | Glentham Life Sciences | Compounds maintained in stock | 98 | As is | in stock |
| P-500417707 | Glentham Life Sciences | Compounds maintained in stock | 98 | As is | in stock |
| P-505492206 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-502444429 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-502597227 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-488556008 | InterBioScreen | Bioactive compounds | 92 | As is | in stock |
| P-488546390 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-524443012 | Key Organics | Biochemicals | 97 | As is | 1.644 g |
| P-579633711 | LabSeeker, Inc | On demand Catalog | 98 | As is | by resynthesis (? - ? days) |
| P-579614648 | LabSeeker, Inc | Stock Collection | 99 | As is | in stock |
| P-856024742 | LaboTest | Screening Collection | 90 | As is | 30 mg |
| P-588253907 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852608417 | Matrix Scientific | All | N/A | As is | in stock |
| P-854718373 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-474025407 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-608274003 | Molnova | Stock | 98 | As is | in stock |
| P-608277120 | Molnova | Stock | 98 | As is | in stock |
| P-881189478 | Otava | In-House Stock Library | 90 | As is | 50 mg |
| P-12322263 | Otava | In-House Stock Library | 90 | As is | 50 mg |
| P-454366206 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-13474796 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-500374857 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-868120644 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 33.23 g |
| P-424797398 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-579710189 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-579703957 | Sinova Inc. | In-stock Building Blocks | N/A | As is | in stock |
| P-888627199 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869108163 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-33163016 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 984 mg |
| P-611440773 | Toronto Research | In stock | 90 | As is | in stock |
| P-2900385 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 305 mg |
| P-25170119 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 2.344 g |
| P-3221721 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 2.344 g |
| P-575298866 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
| P-505389114 | AK Scientific | Building Blocks | 99 | As a main component | in stock |
| P-881672706 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-505393863 | AK Scientific | Building Blocks | 98 | As a main component | in stock |
| P-851570200 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-851599015 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-590850929 | BLD pharm | Non-stock building blocks | 95 | As a main component | by synthesis |
| P-590870648 | BLD pharm | Non-stock building blocks | 98 | As a main component | by synthesis |
| P-868594837 | Combi-Blocks | Building Block in stock | 95 | As a main component | in stock |
| P-870662314 | Glentham Life Sciences | Compounds maintained in stock | 89 | As a main component | in stock |
| P-524164382 | Key Organics | Building Blocks | 99 | As a main component | 5 mg |
| P-524166222 | Key Organics | Building Blocks | 98 | As a main component | 100 g |
| P-524169833 | Key Organics | Building Blocks | 98 | As a main component | 25 g |
| P-856006131 | Key Organics | Screening Compounds and Fragments | 98 | As a main component | 100 mg |
| P-579636320 | LabSeeker, Inc | On demand Catalog | 98 | As a main component | by resynthesis (? - ? days) |
| P-872678664 | MedKoo | In stock compounds | 95 | As a main component | in stock |
| P-888633242 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
| P-869118143 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
| P-611440774 | Toronto Research | In stock | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 361.367 |
| logP | 0.4264 |
| H-bond acceptors | 7 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 79.04 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 100.8527 |
| Atoms | 46 |
| Rings | 4 |
| Heavy atoms | 26 |
| Hydrogen atoms | 20 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
