Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5876498503-0
Structure
Show compound
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 | 11 USD | 99 | 20 working days | Get Quote |
| 5 mg | 11 USD | 99 | 20 working days | Get Quote |
| 10 mg | 11 USD | 99 | 20 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.
-
1
MCULE-8346437605-0
- Component type: Main
-
1
MCULE-7981253226-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5876498503-0.sdf |
| SMILES | MCULE-5876498503-0.smiles |
| Standard InChI | MCULE-5876498503-0.inchi |
| InChIKey | MCULE-5876498503-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867667962 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-505389250 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-505391286 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-596933939 | Angene | Building Blocks in stock | 99 | As is | 50 g |
| P-580194240 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-864136190 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-893238026 | Biosynth | In Stock | 95 | As is | in stock |
| P-580450408 | CliniSciences S.A.S | All products | 99 | As is | in stock |
| P-608219271 | Glentham Life Sciences | Compounds typically in stock | 98 | As is | in stock |
| P-505493081 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-524443045 | Key Organics | Biochemicals | 97 | As is | 863 mg |
| P-856034187 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-500375532 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-424838727 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885538340 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-579710009 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-579710558 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-2588494 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 46 mg |
| P-480919504 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-867611932 | A2B Chem | Predominantly Building Block in stock | 99 | Main component | in stock |
| P-867617635 | A2B Chem | Predominantly Building Block in stock | N/A | Main component | in stock |
| P-852184864 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
| P-535627749 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-535622408 | AK Scientific | Building Blocks | 98 | Main component | in stock |
| P-869298484 | AK Scientific | Building Blocks | 99 | Main component | in stock |
| P-869276852 | AK Scientific | Building Blocks | 99 | Main component | in stock |
| P-610983986 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component | 150.138 g |
| P-675062212 | Alinda | Stock Screening Compounds | 90 | Main component | in stock |
| P-596985042 | Angene | Building Blocks in stock | 99 | Main component | 50 g |
| P-580195680 | Apexbio Technology | Bioactive Compound Library | 98 | Main component | in stock |
| P-864114862 | AstaTech | In Stock BBs | 97 | Main component | in stock |
| P-868545655 | Axon Medchem | Axon predominantly SC catalog | 99 | Main component | in stock |
| P-893237822 | Biosynth | In Stock | 95 | Main component | in stock |
| P-893237823 | Biosynth | In Stock | 95 | Main component | in stock |
| P-893219502 | Biosynth | In Stock | 95 | Main component | in stock |
| P-500418166 | Glentham Life Sciences | Compounds maintained in stock | 99 | Main component | in stock |
| P-868079563 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component | in stock |
| P-524443001 | Key Organics | Biochemicals | 97 | Main component | 506 mg |
| P-500385601 | Pi Chemicals | Virtual Compounds | 98 | Main component | by synthesis |
| P-885538341 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-596714889 | TimTec | ActiMol 1 Week - Stock | 90 | Main component | 950 mg |
| P-611470634 | Toronto Research | In stock | 90 | Main component | in stock |
| P-611440991 | Toronto Research | In stock | 90 | Main component | in stock |
| P-611422903 | Toronto Research | In stock | 90 | Main component | in stock |
| P-611422925 | Toronto Research | In stock | 90 | Main component | in stock |
| P-611617771 | Toronto Research | In stock | 90 | Main component | in stock |
| P-886946616 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 563.636 |
| logP | 4.7476 |
| H-bond acceptors | 9 |
| H-bond donors | 4 |
| Rotatable bonds | 13 |
| PSA | 144.6 |
| RO5 violations | 1 |
| RO3 violations | 6 |
| Refractivity | 157.1932 |
| Atoms | 78 |
| Rings | 3 |
| Heavy atoms | 41 |
| Hydrogen atoms | 37 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
