Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2229401513
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 | 6 USD | 98 | 20 working days | Get Quote |
| 5 mg | 6 USD | 98 | 20 working days | Get Quote |
| 10 mg | 6 USD | 98 | 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-6305507014
- Component type: Main
-
MCULE-9155494525
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2229401513.sdf |
| SMILES | MCULE-2229401513.smiles |
| Standard InChI | MCULE-2229401513.inchi |
| InChIKey | MCULE-2229401513.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867586143 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-852188107 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-867452604 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-875745220 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-535627231 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505347767 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-580237266 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-606864044 | AmBeed | In stock | N/A | As is | in stock |
| P-489192367 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596931587 | Angene | Building Blocks in stock | 98 | As is | 11.66 kg |
| P-895957244 | Apollo Scientific | In Stock | 95 | As is | 100 g |
| P-864112308 | AstaTech | In Stock BBs | 98 | As is | in stock |
| P-580716895 | BLD pharm | In-stock building blocks | 98 | As is | 2.2 kg |
| P-893235573 | Biosynth | In Stock | 95 | As is | in stock |
| P-881633582 | Chemfaces | Natural Compounds | 98 | As is | in stock |
| P-861279903 | Chiralstar | Chiralstar Building Blocks | 97 | As is | in stock |
| P-868576922 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580302052 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-608220780 | Glentham Life Sciences | Compounds maintained in stock | 98 | As is | in stock |
| P-608220289 | Glentham Life Sciences | Compounds maintained in stock | 98 | As is | in stock |
| P-500417990 | Glentham Life Sciences | Compounds maintained in stock | 99 | As is | in stock |
| P-608220781 | Glentham Life Sciences | Compounds maintained in stock | 99 | As is | in stock |
| P-870662151 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-505537625 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-492242913 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502747028 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-503620630 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-524161861 | Key Organics | Building Blocks | 98 | As is | 100 g |
| P-855992068 | Key Organics | Screening Compounds and Fragments | 98 | As is | 100 mg |
| P-579613993 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-856040015 | LaboTest | Building Blocks | 90 | As is | 2 g |
| P-31273589 | LaboTest | Screening Collection | 90 | As is | 2 g |
| P-467930538 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-14557306 | Life Chemicals | Screening Compounds | 90 | As is | 45 mg |
| P-580516584 | Manchester Organics | Stock compounds | N/A | As is | 348 g |
| P-852444438 | Matrix Scientific | All | N/A | As is | in stock |
| P-608279182 | Molnova | Stock | 98 | As is | in stock |
| P-617684576 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 896 mg |
| P-12379488 | Otava | In-House Stock Library | 90 | As is | 896 mg |
| P-888888538 | PharmaBlock | In stock | N/A | As is | in stock |
| P-19150637 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885518960 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-611511301 | Toronto Research | In stock | 90 | As is | in stock |
| P-1211948 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 23 mg |
| P-615393131 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-886671330 | A2B Chem | Predominantly Building Block in stock | 95 | As a main component | in stock |
| P-890178391 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-869272045 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-851767116 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-892192145 | Angene | Building Blocks in stock | 95 | As a main component | 5 g |
| P-890244449 | BLD pharm | In-stock building blocks | 95 | As a main component | 2.2 g |
| P-887075238 | Combi-Blocks | Building Block in stock | 97 | As a main component | in stock |
| P-889336938 | FluoroChem | General BB | 95 | As a main component | in stock |
| P-855919814 | Key Organics | Building Blocks | 97 | As a main component | 5 g |
| P-596574678 | Key Organics | Building Blocks | 97 | As a main component | 250 mg |
| P-870640657 | Key Organics | Screening Compounds and Fragments | 97 | As a main component | 100 mg |
| P-854868467 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
| P-26461798 | Otava | In-House Stock Library | 90 | As a main component | 4.585 g |
| P-617695469 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As a main component | 4.585 g |
| P-611566746 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-894004826 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 115.130 |
| logP | 0.1518 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 49.33 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 32.5235 |
| Atoms | 17 |
| Rings | 1 |
| Heavy atoms | 8 |
| Hydrogen atoms | 9 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
