Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2134025562-0
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 | 9 working days | Get Quote |
| 5 mg | 6 USD | 95 | 9 working days | Get Quote |
| 10 mg | 6 USD | 95 | 9 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-2241188013-0
- Component type: Unknown
-
MCULE-9727943205-0
- Component type: Unknown
-
MCULE-7561074998-0
- Component type: Unknown
-
MCULE-6149251599-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2134025562-0.sdf |
| SMILES | MCULE-2134025562-0.smiles |
| Standard InChI | MCULE-2134025562-0.inchi |
| InChIKey | MCULE-2134025562-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-489140242 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596659042 | Apollo Scientific | In Stock | 95 | As is | in stock |
| P-851245698 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868641356 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-861928481 | FluoroChem | General BB | N/A | As is | in stock |
| P-579619604 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-852488662 | Matrix Scientific | All | N/A | As is | in stock |
| P-852550185 | Matrix Scientific | All | N/A | As is | in stock |
| P-854728650 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-888850272 | PharmaBlock | In stock | N/A | As is | in stock |
| P-613814317 | Spirochem | All | 95 | As is | in stock |
| P-889301289 | FluoroChem | General BB | N/A | As a main component | in stock |
| P-861928487 | FluoroChem | General BB | N/A | As a main component | in stock |
| P-854816746 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
| P-617065776 | Allbio Pharm | In stock | N/A | As a component | in stock |
| P-489218142 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As a component | in stock |
| P-494492339 | Apollo Scientific | On request | 95 | As a component | by resynthesis (? - ? days) |
| P-591106827 | BLD pharm | Non-stock building blocks | 98 | As a component | by synthesis |
| P-580698357 | BLD pharm | In-stock building blocks | 95 | As a component | 242 g |
| P-851247927 | Chemshuttle | On request catalog | 95 | As a component | by synthesis |
| P-868580022 | Combi-Blocks | Building Block in stock | 98 | As a component | in stock |
| P-868584428 | Combi-Blocks | Building Block in stock | 98 | As a component | in stock |
| P-889110908 | FluoroChem | In Stock BB | N/A | As a component | 33.5 g |
| P-862013445 | FluoroChem | General BB | N/A | As a component | in stock |
| P-615638240 | LabNetwork | In stock | 95 | As a component | in stock |
| P-579623883 | LabSeeker, Inc | Stock Collection | 98 | As a component | in stock |
| P-852458972 | Matrix Scientific | All | N/A | As a component | in stock |
| P-852459720 | Matrix Scientific | All | N/A | As a component | in stock |
| P-854726084 | MedChemExpress | In stock Building Blocks | 95 | As a component | in stock |
| P-864062354 | MedChemExpress | Building Blocks on demand | 95 | As a component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 114.189 |
| logP | 1.6156 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 0 |
| PSA | 52.04 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 34.2568 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 8 |
| Hydrogen atoms | 14 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
