Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6604210789
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 | 34 USD | 90 | 17 working days | Get Quote |
| 5 mg | 50 USD | 90 | 17 working days | Get Quote |
| 10 mg | 64 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.
-
1
MCULE-7522420131
- Component type: Main
-
1
MCULE-5889111640
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6604210789.sdf |
| SMILES | MCULE-6604210789.smiles |
| Standard InChI | MCULE-6604210789.inchi |
| InChIKey | MCULE-6604210789.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-854550591 | InterBioScreen | Natural Compounds | 92 | As is | 300 mg |
| P-852129816 | A2B Chem | Predominantly Building Block on demand | 90 | Main component | by synthesis |
| P-890172568 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-851904160 | AmBeed | On request | N/A | Main component | by synthesis |
| P-579787153 | Apollo Scientific | On request | 95 | Main component | by resynthesis (? - ? days) |
| P-596274165 | Asinex | General screening catalog | 90 | Main component | 3 mg |
| P-611113867 | BLD pharm | Non-stock building blocks | 90 | Main component | by synthesis |
| P-666899467 | ChemBridge | EXPRESS-Pick Collection | 90 | Main component | 5 mg |
| P-10634219 | ChemDiv | Discovery Chemistry Library | 90 | Main component | 27 mg |
| P-861371359 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-889380371 | FluoroChem | General BB | N/A | Main component | in stock |
| P-502740000 | Innovapharm | Screening Compounds | 90 | Main component | in stock |
| P-488554778 | InterBioScreen | Building Blocks | 90 | Main component | in stock |
| P-13447637 | InterBioScreen | Screening Compounds | 92 | Main component | 300 mg |
| P-454394313 | Key Organics | Building Blocks | 90 | Main component | 6.513 g |
| P-18801008 | Key Organics | Screening Compounds and Fragments | 90 | Main component | 6.513 g |
| P-854924036 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-454375330 | Pharmeks LLC | Building Blocks | 92 | Main component | in stock |
| P-445300690 | Pharmeks LLC | Synthetic compounds | 92 | Main component | in stock |
| P-19174054 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-579252543 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-491307456 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-12552946 | Specs | Screening Compounds | 90 | Main component | 159 mg |
| P-33807648 | TimTec | ActiMol 6 Week | 90 | Main component | in stock |
| P-852061844 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | Main component | 105 mg |
| P-852011675 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 105 mg |
| P-3249185 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | Main component | 215 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 358.388 |
| logP | 3.4891 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 3 |
| PSA | 130.58 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 98.2405 |
| Atoms | 48 |
| Rings | 3 |
| Heavy atoms | 26 |
| Hydrogen atoms | 22 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| 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 |
