Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1871275332
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 | 31 USD | 95 | 15 working days | Get Quote |
| 5 mg | 31 USD | 95 | 15 working days | Get Quote |
| 10 mg | 31 USD | 95 | 15 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-1871275332.sdf |
| SMILES | MCULE-1871275332.smiles |
| Standard InChI | MCULE-1871275332.inchi |
| InChIKey | MCULE-1871275332.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886607655 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-890156607 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869237422 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-436474094 | Alinda | Building Blocks | 95 | As is | 27 g |
| P-34884185 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-886886886 | AmBeed | In stock | N/A | As is | in stock |
| P-892190200 | Angene | Building Blocks in stock | 95 | As is | 10 g |
| P-494310168 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-889780780 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-890244644 | BLD pharm | In-stock building blocks | 95 | As is | 9.9 g |
| P-454683507 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-15153482 | ChemDiv | Discovery Chemistry Library | 90 | As is | 12 mg |
| P-436442695 | Chemical Block | Building Blocks | 90 | As is | 5.46 g |
| P-337573 | Chemical Block | Screening Library | 90 | As is | 467 mg |
| P-861485759 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-34728698 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-862055846 | FluoroChem | General BB | N/A | As is | in stock |
| P-502564732 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-504558004 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-855978100 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-852533939 | Matrix Scientific | All | N/A | As is | in stock |
| P-428004607 | Maybridge | Screening Collection | 90 | As is | 1.145 kg |
| P-869033796 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-19648005 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-33442490 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502340600 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888497198 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-611611597 | Toronto Research | In stock | 90 | As is | in stock |
| P-1403055 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 64 mg |
| P-893999362 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 230.237 |
| logP | 3.3144 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 55.12 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 65.0186 |
| Atoms | 28 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 11 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
