Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1431282094-1
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 | 5 USD | 95 | 16 working days | Get Quote |
| 5 mg | 5 USD | 95 | 16 working days | Get Quote |
| 10 mg | 5 USD | 95 | 16 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-1852417179-1
- Component type: Main
-
MCULE-7276691240-1
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1431282094-1.sdf |
| SMILES | MCULE-1431282094-1.smiles |
| Standard InChI | MCULE-1431282094-1.inchi |
| InChIKey | MCULE-1431282094-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867563799 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875722985 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-489105500 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-868572052 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-580417748 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-890222175 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-865986420 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | in stock |
| P-492218041 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-579637511 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-852401932 | Matrix Scientific | All | N/A | As is | in stock |
| P-881191914 | Otava | In-House Stock Library | 90 | As is | 50 mg |
| P-13678944 | Pharmeks LLC | Synthetic compounds | 92 | As is | in stock |
| P-889862547 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596735858 | Synthonix | In-stock Building Blocks | 97 | As is | 533.75 g |
| P-33442817 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-888361276 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-611497729 | Toronto Research | In stock | 90 | As is | in stock |
| P-867559066 | A2B Chem | Predominantly Building Block in stock | 95 | As a main component | in stock |
| P-889925756 | AA Blocks | AA Blocks - synthesis | N/A | As a main component | by synthesis |
| P-875718906 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-580454662 | AEchem | Building blocks | 95 | As a main component | in stock |
| P-851446931 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-590803887 | BLD pharm | Non-stock building blocks | 98 | As a main component | by synthesis |
| P-868597493 | Combi-Blocks | Building Block in stock | 98 | As a main component | in stock |
| P-889440160 | FluoroChem | General BB | N/A | As a main component | in stock |
| P-488548916 | InterBioScreen | Building Blocks | 90 | As a main component | in stock |
| P-854421141 | InterBioScreen | Screening Compounds | 92 | As a main component | 300 mg |
| P-854836238 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
| P-454367809 | Pharmeks LLC | Building Blocks | 92 | As a main component | in stock |
| P-864658481 | Pharmeks LLC | Synthetic compounds | 92 | As a main component | in stock |
| P-889866064 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As a main component | by synthesis |
| P-892261206 | TargetMol | Screening Compounds - synthesis | 95 | As a main component | by synthesis |
| P-892342649 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | unavailable |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 126.117 |
| logP | 0.3723 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 1 |
| PSA | 97.79 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 31.087 |
| Atoms | 15 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 6 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
