Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8717487705
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 | 10 USD | 95 | 14 working days | Get Quote |
| 5 mg | 10 USD | 95 | 14 working days | Get Quote |
| 10 mg | 10 USD | 95 | 14 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-8717487705.sdf |
| SMILES | MCULE-8717487705.smiles |
| Standard InChI | MCULE-8717487705.inchi |
| InChIKey | MCULE-8717487705.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867435306 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-869181196 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-590380390 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-851924676 | AmBeed | In stock | N/A | As is | in stock |
| P-895958304 | Apollo Scientific | In Stock | 95 | As is | 1.1 kg |
| P-864145038 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-605404974 | BLD pharm | Non-stock building blocks | 99 | As is | by synthesis |
| P-619600468 | BLD pharm | In-stock building blocks | 99 | As is | 3 kg |
| P-893241063 | Biosynth | In Stock | 95 | As is | in stock |
| P-868609208 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-881676228 | EDASA Scientific Limited | Synthesis Building Blocks | N/A | As is | by resynthesis (? - ? days) |
| P-901372048 | FluoroChem | In Stock BB | N/A | As is | 600 g |
| P-608220883 | Glentham Life Sciences | Compounds maintained in stock | 97 | As is | in stock |
| P-870648869 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-563559770 | Key Organics | Building Blocks | 95 | As is | 100 g |
| P-524164557 | Key Organics | Building Blocks | 98 | As is | 25 g |
| P-524164558 | Key Organics | Building Blocks | 98 | As is | 1000 mg |
| P-855992651 | Key Organics | Screening Compounds and Fragments | 98 | As is | 100 mg |
| P-855992652 | Key Organics | Screening Compounds and Fragments | 98 | As is | 100 mg |
| P-855994297 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
| P-579613762 | LabSeeker, Inc | Stock Collection | 97 | As is | in stock |
| P-579617945 | LabSeeker, Inc | Stock Collection | 90 | As is | in stock |
| P-856010486 | LaboTest | Screening Collection | 90 | As is | 10 g |
| P-613282133 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-870641549 | Manchester Organics | Compounds on demand | 98 | As is | by synthesis |
| P-855402515 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-500405136 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-23969338 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885524388 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-611424491 | Toronto Research | In stock | 90 | As is | in stock |
| P-855006503 | Toronto Research | In stock | 90 | As is | in stock |
| P-855006504 | Toronto Research | In stock | 90 | As is | in stock |
| P-3229649 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1000 mg |
| P-2325742 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1000 mg |
| P-854679420 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 132.157 |
| logP | 0.1302 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 38.69 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 32.2118 |
| Atoms | 21 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 12 |
| 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 |
