Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4967617963
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 | 20 working days | Get Quote |
| 5 mg | 7 USD | 98 | 20 working days | Get Quote |
| 10 mg | 7 USD | 98 | 20 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-4967617963.sdf |
| SMILES | MCULE-4967617963.smiles |
| Standard InChI | MCULE-4967617963.inchi |
| InChIKey | MCULE-4967617963.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867561824 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875722312 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869190664 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505400296 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-34859163 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-851935983 | AmBeed | In stock | N/A | As is | in stock |
| P-596987427 | Angene | Building Blocks in stock | 98 | As is | 5.5 kg |
| P-494346435 | Apollo Scientific | In Stock | 95 | As is | 66.72 g |
| P-864196361 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-674400947 | BLD pharm | In-stock building blocks | 98 | As is | 1.35 kg |
| P-900267724 | BOC Sciences | All products | N/A | As is | by resynthesis (? - ? days) |
| P-901452785 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-868642442 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580285367 | Debye Scientific | General Catalog | N/A | As is | by resynthesis (? - ? days) |
| P-901375123 | FluoroChem | In Stock BB | N/A | As is | 600 g |
| P-502455182 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-502597101 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-492214364 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-12586051 | InterBioScreen | Screening Compounds | 92 | As is | unavailable |
| P-454398986 | Key Organics | Building Blocks | 95 | As is | 89 mg |
| P-454312408 | Key Organics | Screening Compounds and Fragments | 95 | As is | 89 mg |
| P-31135830 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-613282603 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-852510246 | Matrix Scientific | All | N/A | As is | in stock |
| P-428009715 | Maybridge | Screening Collection | 95 | As is | 16.753 kg |
| P-872796097 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-445322376 | Pharmeks LLC | Synthetic compounds | 92 | As is | 260 mg |
| P-18855490 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-889882867 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-896079916 | Specs | Repurposed Compounds | N/A | As is | 3.399 g |
| P-22636793 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502350493 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888432964 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-888430587 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-611430904 | Toronto Research | In stock | 90 | As is | in stock |
| P-1080308 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 326 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 168.189 |
| logP | 0.6852 |
| H-bond acceptors | 3 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 60.69 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 45.6866 |
| Atoms | 24 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 12 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
