Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4925828593-0
Structure
Show compound
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 | 95 | 20 working days | Get Quote |
| 5 mg | 6 USD | 95 | 20 working days | Get Quote |
| 10 mg | 6 USD | 95 | 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.
-
1
MCULE-1447753966-0
- Component type: Main
-
4
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4925828593-0.sdf |
| SMILES | MCULE-4925828593-0.smiles |
| Standard InChI | MCULE-4925828593-0.inchi |
| InChIKey | MCULE-4925828593-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875755497 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-595218302 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-617324390 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-893226620 | Biosynth | In Stock | 95 | As is | in stock |
| P-868602096 | Combi-Blocks | Building Block in stock | 96 | As is | in stock |
| P-870662754 | Glentham Life Sciences | Compounds maintained in stock | 96 | As is | in stock |
| P-596574247 | Key Organics | Building Blocks | 97 | As is | 25 g |
| P-608113836 | LabSeeker, Inc | Stock Collection | 99 | As is | in stock |
| P-852463141 | Matrix Scientific | All | N/A | As is | in stock |
| P-500397859 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-885548607 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-23117540 | TimTec | ActiMol 2 Week | 90 | As is | in stock |
| P-867563313 | A2B Chem | Predominantly Building Block in stock | N/A | Main component | in stock |
| P-875722879 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-535626170 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-505389994 | AK Scientific | Building Blocks | 98 | Main component | in stock |
| P-851944539 | AmBeed | In stock | N/A | Main component | in stock |
| P-489194990 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component | in stock |
| P-596928256 | Angene | Building Blocks in stock | 95 | Main component | 5 kg |
| P-864108520 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-893226606 | Biosynth | In Stock | 95 | Main component | in stock |
| P-851284424 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-868580210 | Combi-Blocks | Building Block in stock | 97 | Main component | in stock |
| P-580304544 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
| P-494300537 | Frinton Laboratories | Frinton Building Blocks | 98 | Main component | in stock |
| P-500417373 | Glentham Life Sciences | Compounds maintained in stock | 98 | Main component | in stock |
| P-524164733 | Key Organics | Building Blocks | 99 | Main component | 5 g |
| P-856005893 | Key Organics | Screening Compounds and Fragments | 99 | Main component | 100 mg |
| P-579616637 | LabSeeker, Inc | Stock Collection | 97 | Main component | in stock |
| P-31248669 | LaboTest | Screening Collection | 90 | Main component | unavailable |
| P-860787962 | Manchester Organics | Compounds on demand | 98 | Main component | by synthesis |
| P-852550840 | Matrix Scientific | All | N/A | Main component | in stock |
| P-500405032 | Pi Chemicals | Virtual Compounds | 98 | Main component | by synthesis |
| P-885548608 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-502332639 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-875236834 | TimTec | ActiMol 1 Week - Stock | 90 | Main component | 100 mg |
| P-856019696 | LaboTest | Screening Collection | 90 | Main component as a main component | unavailable |
| Property | Value |
|---|---|
| Components | 5 |
| Mass | 360.104 |
| logP | 7.2152 |
| H-bond acceptors | 4 |
| H-bond donors | 4 |
| Rotatable bonds | 1 |
| PSA | 104.08 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 97.3556 |
| Atoms | 38 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 18 |
| Heteroatoms | 8 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 4 |
| 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 |
