Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7113663407
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 | 13 USD | 98 | 16 working days | Get Quote |
| 5 mg | 13 USD | 98 | 16 working days | Get Quote |
| 10 mg | 13 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-3859111438
- Component type: Unknown
-
MCULE-5112248677
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7113663407.sdf |
| SMILES | MCULE-7113663407.smiles |
| Standard InChI | MCULE-7113663407.inchi |
| InChIKey | MCULE-7113663407.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867555542 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875714583 | AA Blocks | AA Blocks | N/A | As is | in stock |
| P-869183872 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-869274303 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-505393778 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-19986722 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-436472071 | Alinda | Building Blocks | 95 | As is | in stock |
| P-489108741 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-494347070 | Apollo Scientific | In Stock | 95 | As is | in stock |
| P-864163977 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-481169459 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 1.038 kg |
| P-454633345 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-868593103 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-34736219 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-861980163 | FluoroChem | General BB | N/A | As is | in stock |
| P-500417949 | Glentham Life Sciences | Compounds maintained in stock | 95 | As is | in stock |
| P-505512240 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-502446233 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-502692577 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-492215467 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-524444356 | Key Organics | Biochemicals | 97 | As is | unavailable |
| P-31144212 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-580510451 | Manchester Organics | Stock compounds | 95 | As is | 444 g |
| P-852451056 | Matrix Scientific | All | N/A | As is | in stock |
| P-872798784 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-584624111 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-12800381 | Otava | In-House Stock Library | 90 | As is | 257 mg |
| P-617694969 | Otava | Chemical Building Blocks for Prompt Delivery | 90 | As is | 257 mg |
| P-500372893 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-34120820 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885549793 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-888651769 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869153709 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-502327027 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22500094 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 1000 mg |
| P-611465220 | Toronto Research | In stock | 90 | As is | in stock |
| P-3241232 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 1.14 g |
| P-831881 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.14 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 241.455 |
| logP | 2.9034 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 76.21 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 50.6307 |
| Atoms | 16 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 3 |
| Heteroatoms | 7 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
