Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1748959240-0
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 | 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.
-
1
MCULE-6692975244-1
- Component type: Counter Ion
-
1
MCULE-3497956371-0
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-1748959240-0.sdf |
| SMILES | MCULE-1748959240-0.smiles |
| Standard InChI | MCULE-1748959240-0.inchi |
| InChIKey | MCULE-1748959240-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867565858 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875725690 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590416218 | AK Scientific | Building Blocks | 96 | As is | in stock |
| P-596987502 | Angene | Building Blocks in stock | 98 | As is | 175 g |
| P-589659719 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864198640 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-893237247 | Biosynth | In Stock | 95 | As is | in stock |
| P-868616391 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-889441758 | FluoroChem | General BB | 98 | As is | in stock |
| P-855982672 | Key Organics | Building Blocks | 95 | As is | 25 g |
| P-874449011 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-885536173 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-855015286 | Toronto Research | In stock | 90 | As is | in stock |
| P-893913310 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 181.256 |
| logP | 1.6399 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 86.54 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 43.5025 |
| Atoms | 26 |
| Rings | 0 |
| Heavy atoms | 11 |
| Hydrogen atoms | 15 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |
