Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2720595773-0
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 | 5 USD | 98 | 8 working days | Get Quote |
| 5 mg | 5 USD | 98 | 8 working days | Get Quote |
| 10 mg | 5 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.
-
1
MCULE-3914949169-1
- Component type: Main
-
1
MCULE-3833394421-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2720595773-0.sdf |
| SMILES | MCULE-2720595773-0.smiles |
| Standard InChI | MCULE-2720595773-0.inchi |
| InChIKey | MCULE-2720595773-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875687593 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869183742 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-590416188 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-606929689 | AmBeed | In stock | N/A | As is | in stock |
| P-489169679 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596935323 | Angene | Building Blocks in stock | 98 | As is | 1000 g |
| P-895930688 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864155568 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-590599280 | BLD pharm | In-stock building blocks | 98 | As is | 1.162 kg |
| P-893226325 | Biosynth | In Stock | 95 | As is | in stock |
| P-868610634 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-862091366 | FluoroChem | General BB | 95 | As is | in stock |
| P-870663074 | Glentham Life Sciences | Compounds maintained in stock | 98 | As is | in stock |
| P-596567537 | Key Organics | Building Blocks | 97 | As is | 5 g |
| P-31248514 | LaboTest | Screening Collection | 90 | As is | 2 g |
| P-580467714 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852599479 | Matrix Scientific | All | N/A | As is | in stock |
| P-871075587 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-878647145 | Molnova | Stock | 98 | As is | in stock |
| P-885537127 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-892302642 | TargetMol | Natural Products | 95 | As is | in stock |
| P-869126406 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892290941 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888639799 | TargetMol | Screening Compounds - stock amount | 95 | As is | 200 mg |
| P-611447771 | Toronto Research | In stock | 90 | As is | in stock |
| P-480350410 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-892957901 | A2B Chem | Predominantly Building Block on demand | N/A | Main component as a main component | by synthesis |
| P-867398571 | A2B Chem | Predominantly Building Block on demand | N/A | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 194.246 |
| logP | 1.877 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 8 |
| PSA | 40.13 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 50.0135 |
| Atoms | 32 |
| Rings | 0 |
| Heavy atoms | 13 |
| Hydrogen atoms | 19 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| Inorganic atoms | 1 |
| 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 |
