Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1297023918
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 | 28 USD | 98 | 8 working days | Get Quote |
| 5 mg | 28 USD | 98 | 8 working days | Get Quote |
| 10 mg | 28 USD | 98 | 8 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.
| Name | File |
|---|---|
| SDF | MCULE-1297023918.sdf |
| SMILES | MCULE-1297023918.smiles |
| Standard InChI | MCULE-1297023918.inchi |
| InChIKey | MCULE-1297023918.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867592618 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875751507 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590387912 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-903083555 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As is | 5 g |
| P-606932951 | AmBeed | In stock | N/A | As is | in stock |
| P-489143935 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-865911481 | Angene | Building Blocks in stock | 98 | As is | 750 mg |
| P-869385113 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-861315768 | BLD pharm | In-stock building blocks | 98 | As is | 1000 mg |
| P-868557441 | Combi-Blocks | Building Block in stock | N/A | As is | in stock |
| P-893294556 | Key Organics | Screening Compounds and Fragments | 97 | As is | 1000 mg |
| P-855934309 | Key Organics | Building Blocks | 97 | As is | 5 g |
| P-852461359 | Matrix Scientific | All | N/A | As is | in stock |
| P-895256809 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-888878832 | PharmaBlock | In stock | N/A | As is | in stock |
| P-889874474 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502407014 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-906835701 | Titan Scientific | Predominantly Building Block on demand | 98 | As is | by synthesis |
| P-855220151 | Toronto Research | In stock | 90 | As is | in stock |
| P-590439355 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 246.981 |
| logP | 0.0494 |
| H-bond acceptors | 4 |
| H-bond donors | 3 |
| Rotatable bonds | 5 |
| PSA | 69.56 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 54.2618 |
| Atoms | 26 |
| Rings | 1 |
| Heavy atoms | 17 |
| Hydrogen atoms | 9 |
| Heteroatoms | 8 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
