Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3471045786
Compound
Show structure
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 | 22 working days | Get Quote |
| 5 mg | 5 USD | 98 | 22 working days | Get Quote |
| 10 mg | 5 USD | 98 | 22 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.
| Name | File |
|---|---|
| SDF | MCULE-3471045786.sdf |
| SMILES | MCULE-3471045786.smiles |
| Standard InChI | MCULE-3471045786.inchi |
| InChIKey | MCULE-3471045786.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867588514 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875747824 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869186887 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-579760754 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-851950231 | AmBeed | In stock | N/A | As is | in stock |
| P-489172804 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596976553 | Angene | Building Blocks in stock | 98 | As is | 20.495 kg |
| P-895930006 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-895934748 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-494342081 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864131783 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-889740475 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 150 g |
| P-608391604 | BLD pharm | In-stock building blocks | 98 | As is | 1.38 kg |
| P-851288341 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868600540 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580272464 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-889111388 | FluoroChem | In Stock BB | 95 | As is | 50 g |
| P-494299681 | Frinton Laboratories | Frinton Building Blocks | 98 | As is | in stock |
| P-870656245 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-855379981 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 6 g |
| P-890221257 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-505525544 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-580093132 | Iris Biotech GmbH | Building Block Library | N/A | As is | in stock |
| P-563562560 | Key Organics | Building Blocks | 95 | As is | 250 g |
| P-855994300 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
| P-579616437 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-856043944 | LaboTest | Building Blocks | 90 | As is | unavailable |
| P-31177269 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-860795696 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852425654 | Matrix Scientific | All | N/A | As is | in stock |
| P-854730160 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-500373279 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-859998901 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596759930 | Synthonix | In-stock Building Blocks | 95 | As is | 40.839 kg |
| P-502331849 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22519233 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 1000 mg |
| P-611509430 | Toronto Research | In stock | 90 | As is | in stock |
| P-580449357 | Trans World Chemicals | A-chem Products | 97 | As is | in stock |
| P-615398182 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 219.193 |
| logP | 1.377 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 63.68 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 58.009 |
| Atoms | 25 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 9 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
