Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8677230473
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 | 48 USD | 98 | 12 working days | Get Quote |
| 5 mg | 48 USD | 98 | 12 working days | Get Quote |
| 10 mg | 48 USD | 98 | 12 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-8926826744
- Component type: Main
-
MCULE-2671517685
- Component type: Main
-
MCULE-5063174947
- Component type: Main
-
MCULE-7461567431
- Component type: Main
-
MCULE-4365741857
- Component type: Main
-
MCULE-3269112218
- Component type: Main
-
MCULE-9141719967
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8677230473.sdf |
| SMILES | MCULE-8677230473.smiles |
| Standard InChI | MCULE-8677230473.inchi |
| InChIKey | MCULE-8677230473.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-893137383 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-892858872 | A2B Chem | Predominantly Building Block in stock | N/A | As is | in stock |
| P-893109689 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-890150933 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-892189230 | Angene | Building Blocks in stock | N/A | As is | 100 mg |
| P-861285841 | Chiralstar | Chiralstar Building Blocks | 95 | As is | in stock |
| P-894007997 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-867397305 | A2B Chem | Predominantly Building Block on demand | N/A | As a main component | by synthesis |
| P-872726858 | Apexbio Technology | Bioactive Compound Library | 98 | As a main component | in stock |
| P-872724943 | Apexbio Technology | Bioactive Compound Library | 98 | As a main component | in stock |
| P-870660715 | Glentham Life Sciences | Compounds typically in stock | N/A | As a main component | in stock |
| P-870661480 | Glentham Life Sciences | Compounds typically in stock | 95 | As a main component | in stock |
| P-890848986 | Innovapharm | Building Blocks | 95 | As a main component | in stock |
| P-890849232 | Innovapharm | Building Blocks | 95 | As a main component | in stock |
| P-890849717 | Innovapharm | Building Blocks | 95 | As a main component | in stock |
| P-890849747 | Innovapharm | Building Blocks | 95 | As a main component | in stock |
| P-855910277 | Key Organics | Building Blocks | 95 | As a main component | 500 mg |
| P-650817540 | Otava | Tangible screening compounds | 90 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 507.181 |
| logP | -1.0478 |
| H-bond acceptors | 18 |
| H-bond donors | 7 |
| Rotatable bonds | 8 |
| PSA | 308.56 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 95.4047 |
| Atoms | 47 |
| Rings | 3 |
| Heavy atoms | 31 |
| Hydrogen atoms | 16 |
| Heteroatoms | 21 |
| N/O atoms | 18 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 4 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
