Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4958892714
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 | 8 USD | 97 | 20 working days | Get Quote |
| 5 mg | 8 USD | 97 | 20 working days | Get Quote |
| 10 mg | 8 USD | 97 | 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.
-
MCULE-3644396324
- Component type: Main
-
MCULE-2000342336
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4958892714.sdf |
| SMILES | MCULE-4958892714.smiles |
| Standard InChI | MCULE-4958892714.inchi |
| InChIKey | MCULE-4958892714.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867584709 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
| P-875742804 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-505390435 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-19991732 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-875897818 | Allbio Pharm | Backorder | 95 | As is | by resynthesis (? - ? days) |
| P-868816513 | AmBeed | On request | N/A | As is | by synthesis |
| P-489113488 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-865909878 | Angene | Building Blocks in stock | 97 | As is | 78 g |
| P-864134879 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580708460 | BLD pharm | In-stock building blocks | 98 | As is | 4.94 kg |
| P-454639454 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-851248741 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-861416871 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-34753777 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-580417924 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-864499436 | Eximed | In-stock screening compounds | 90 | As is | 800 mg |
| P-862017386 | FluoroChem | General BB | N/A | As is | in stock |
| P-870657852 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-890212507 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-579523715 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | in stock |
| P-505492450 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-492238900 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-503002449 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-503896153 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-524164871 | Key Organics | Building Blocks | 98 | As is | 5 g |
| P-855992714 | Key Organics | Screening Compounds and Fragments | 98 | As is | 100 mg |
| P-579635667 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-31178763 | LaboTest | Screening Collection | 90 | As is | 10 g |
| P-856044658 | LaboTest | Building Blocks | 90 | As is | 10 g |
| P-613284948 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-580465536 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852504663 | Matrix Scientific | All | N/A | As is | in stock |
| P-35174085 | Maybridge | Screening Collection | 90 | As is | 8.456 kg |
| P-13125935 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
| P-620237685 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1000 mg |
| P-18843843 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885516181 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502331811 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22519922 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 99 mg |
| P-611385410 | Toronto Research | In stock | 90 | As is | in stock |
| P-481011667 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 195.201 |
| logP | 2.8911 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 112.97 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 52.8464 |
| Atoms | 18 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 5 |
| Heteroatoms | 6 |
| 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 |
