Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
UNKNOWN STEREO
MCULE-5904390200
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 | 95 | 10 working days | Get Quote |
| 5 mg | 5 USD | 95 | 10 working days | Get Quote |
| 10 mg | 5 USD | 95 | 10 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-3942804599
- Component type: Main
-
2
MCULE-6872461833
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5904390200.sdf |
| SMILES | MCULE-5904390200.smiles |
| Standard InChI | MCULE-5904390200.inchi |
| InChIKey | MCULE-5904390200.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-590370925 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-851862048 | AmBeed | On request | N/A | As is | by synthesis |
| P-867662891 | A2B Chem | Predominantly Building Block in stock | 98 | Main component | in stock |
| P-875832253 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-889055306 | AK Scientific | Building Blocks | N/A | Main component | in stock |
| P-580197805 | Aldlab Chemicals | Building Block Stock | 95 | Main component | 1.02 kg |
| P-596933830 | Angene | Building Blocks in stock | 99 | Main component | 5 kg |
| P-864136572 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-864183711 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-893237434 | Biosynth | In Stock | 95 | Main component | in stock |
| P-580288578 | Debye Scientific | General Catalog | N/A | Main component | by resynthesis (? - ? days) |
| P-579484446 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | Main component | 2.94 g |
| P-890204780 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | Main component | in stock |
| P-613332726 | Life Chemicals | Building Blocks - virtual | 95 | Main component | by synthesis |
| P-620068193 | Otava | In-House Stock Library | 90 | Main component | 1000 mg |
| P-594274048 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-892295669 | TargetMol | In Stock BB | 95 | Main component | 1000 mg |
| P-892338062 | TargetMol | Screening Compounds - stock amount | 95 | Main component | 1000 mg |
| P-855071587 | Toronto Research | In stock | 90 | Main component | in stock |
| P-575326114 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| P-867562880 | A2B Chem | Predominantly Building Block in stock | 99 | Main component as a main component | in stock |
| P-867661003 | A2B Chem | Predominantly Building Block in stock | 99 | Main component as a main component | in stock |
| P-860607283 | A2B Chem | Predominantly Building Block on demand | N/A | Main component as a main component | by synthesis |
| P-867486214 | A2B Chem | Predominantly Building Block on demand | N/A | Main component as a main component | by synthesis |
| P-890143318 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-875720935 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-875736780 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-875829669 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-616207918 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-853423349 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-881671464 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-869230108 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-851400003 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-875900501 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-885359456 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-851591466 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-851592476 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-870664125 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-851950369 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-851951478 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-597006593 | Angene | Building Blocks in stock | 98 | Main component as a main component | 1000 g |
| P-619129901 | Angene | Building Blocks in stock | 95 | Main component as a main component | 200 g |
| P-619178550 | Angene | Building Blocks in stock | 98 | Main component as a main component | 6.5 kg |
| P-597005680 | Angene | Building Blocks in stock | 99 | Main component as a main component | 500 g |
| P-864208623 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-864209329 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-889490430 | AstaTech | Backordered BBs | 95 | Main component as a main component | by synthesis |
| P-873287217 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-864196995 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-893227083 | Biosynth | In Stock | 95 | Main component as a main component | in stock |
| P-899774184 | Life Chemicals | Building Blocks - virtual | 95 | Main component as a main component | by synthesis |
| P-855053839 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-855050963 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-575295226 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| P-666970469 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 162.006 |
| logP | -4.792 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 120.72 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 23.3246 |
| Atoms | 16 |
| Rings | 0 |
| Heavy atoms | 12 |
| Hydrogen atoms | 4 |
| Heteroatoms | 8 |
| N/O atoms | 6 |
| Inorganic atoms | 2 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
