Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3445136217
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 | 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.
| Name | File |
|---|---|
| SDF | MCULE-3445136217.sdf |
| SMILES | MCULE-3445136217.smiles |
| Standard InChI | MCULE-3445136217.inchi |
| InChIKey | MCULE-3445136217.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867611855 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875771946 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-597024589 | AEchem | Building blocks | 97 | As is | in stock |
| P-869195512 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505398047 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-610991718 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 1.9175 kg |
| P-608432476 | Aldlab Chemicals | Building Block Stock | 95 | As is | 49.773 g |
| P-517101803 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-606844034 | AmBeed | In stock | N/A | As is | in stock |
| P-489112726 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596932480 | Angene | Building Blocks in stock | 98 | As is | 200 g |
| P-494395981 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864102068 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580714220 | BLD pharm | In-stock building blocks | 98 | As is | 272.5 g |
| P-851262655 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868584210 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580432298 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-861984779 | FluoroChem | General BB | N/A | As is | in stock |
| P-454403977 | Key Organics | Building Blocks | 95 | As is | 5 g |
| P-855998125 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
| P-579623608 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-580504956 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852442351 | Matrix Scientific | All | N/A | As is | in stock |
| P-854733101 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-12633875 | Otava | In-House Stock Library | 90 | As is | 1.8 g |
| P-492279231 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1.8 g |
| P-888898090 | PharmaBlock | In stock | N/A | As is | in stock |
| P-500405649 | Pi Chemicals | Virtual Compounds | 97 | As is | by synthesis |
| P-596745666 | Synthonix | In-stock Building Blocks | 98 | As is | 1.10975 kg |
| P-873229245 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888585997 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-615454269 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 187.033 |
| logP | 2.4631 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 20.23 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 41.131 |
| Atoms | 16 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 7 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
