Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5665252529
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 | 33 USD | 90 | 17 working days | Get Quote |
| 5 mg | 35 USD | 90 | 17 working days | Get Quote |
| 10 mg | 41 USD | 90 | 17 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-5665252529.sdf |
| SMILES | MCULE-5665252529.smiles |
| Standard InChI | MCULE-5665252529.inchi |
| InChIKey | MCULE-5665252529.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852138634 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-889952616 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-19881309 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-436463196 | Alinda | Building Blocks | 95 | As is | in stock |
| P-851403714 | AmBeed | On request | N/A | As is | by synthesis |
| P-590826112 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-454719871 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-449231039 | ChemDiv | Discovery Chemistry Library | 90 | As is | 34 mg |
| P-861529634 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-862067153 | FluoroChem | General BB | N/A | As is | in stock |
| P-502544001 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-503864890 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-855974611 | Key Organics | Building Blocks | 95 | As is | 500 mg |
| P-852433820 | Matrix Scientific | All | N/A | As is | in stock |
| P-854924265 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-641781619 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
| P-19438461 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-22839691 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-888481302 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-855310713 | Toronto Research | In stock | 90 | As is | in stock |
| P-25153265 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 106 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 271.267 |
| logP | 2.7187 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 75.63 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 74.1075 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 13 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
