Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5054241122
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 | 8 USD | 98 | 20 working days | Get Quote |
| 5 mg | 8 USD | 98 | 20 working days | Get Quote |
| 10 mg | 8 USD | 98 | 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.
-
MCULE-4624158450
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5054241122.sdf |
| SMILES | MCULE-5054241122.smiles |
| Standard InChI | MCULE-5054241122.inchi |
| InChIKey | MCULE-5054241122.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867560186 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875721378 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869188515 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-588246609 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-851934354 | AmBeed | In stock | N/A | As is | in stock |
| P-489137474 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596982579 | Angene | Building Blocks in stock | 98 | As is | 125 g |
| P-895924570 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-893262053 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-868577097 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-889115811 | FluoroChem | In Stock BB | 95 | As is | 75 g |
| P-505491765 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-502945832 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-855983063 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-893278246 | LabSeeker, Inc | On demand Catalog | 97 | As is | by resynthesis (? - ? days) |
| P-872795950 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-492279965 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 32.999 g |
| P-12681073 | Otava | In-House Stock Library | 90 | As is | 32.999 g |
| P-885540452 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-855345571 | Toronto Research | In stock | 90 | As is | in stock |
| P-666973840 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 136.191 |
| logP | 2.3174 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 20.23 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 43.363 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 12 |
| Heteroatoms | 1 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
