Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2605695512
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 | 7 USD | 98 | 16 working days | Get Quote |
| 5 mg | 7 USD | 98 | 16 working days | Get Quote |
| 10 mg | 7 USD | 98 | 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.
| Name | File |
|---|---|
| SDF | MCULE-2605695512.sdf |
| SMILES | MCULE-2605695512.smiles |
| Standard InChI | MCULE-2605695512.inchi |
| InChIKey | MCULE-2605695512.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867608146 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875767078 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-610897982 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | As is | by synthesis |
| P-606928171 | AmBeed | In stock | N/A | As is | in stock |
| P-489227570 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596961600 | Angene | Building Blocks in stock | 98 | As is | 42.4 g |
| P-494321897 | Apollo Scientific | In Stock | 95 | As is | in stock |
| P-864098311 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580697410 | BLD pharm | In-stock building blocks | 98 | As is | 1000 mg |
| P-851280958 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868580802 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-861952381 | FluoroChem | General BB | N/A | As is | in stock |
| P-870646705 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-890209847 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-579516032 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | in stock |
| P-502552524 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-870638378 | Key Organics | Building Blocks | 90 | As is | 5.145 g |
| P-18802623 | Key Organics | Screening Compounds and Fragments | 90 | As is | 5.145 g |
| P-615651517 | LabNetwork | In stock | 95 | As is | in stock |
| P-608117434 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-856015431 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-852485765 | Matrix Scientific | All | N/A | As is | in stock |
| P-854747339 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-859985178 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502401903 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611376251 | Toronto Research | In stock | 90 | As is | in stock |
| P-886932680 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 219.160 |
| logP | 2.4901 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 45.6962 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 8 |
| Heteroatoms | 6 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
