Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2827451677
Compound
Show structures
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 | 22 USD | 95 | 14 working days | Get Quote |
| 5 mg | 22 USD | 95 | 14 working days | Get Quote |
| 10 mg | 22 USD | 95 | 14 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.
-
MCULE-4045148324
- Component type: Main
-
MCULE-2580801581
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2827451677.sdf |
| SMILES | MCULE-2827451677.smiles |
| Standard InChI | MCULE-2827451677.inchi |
| InChIKey | MCULE-2827451677.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867552370 | 95 | As is | in stock |
| P-875710477 | N/A | As is | in stock |
| P-590419292 | 99 | As is | in stock |
| P-903037201 | 98 | As is | 1000 mg |
| P-893540561 | 90 | As is | unavailable |
| P-903000751 | N/A | As is | in stock |
| P-489150783 | 97 | As is | in stock |
| P-888814232 | 98 | As is | 50 g |
| P-866724268 | 95 | As is | by resynthesis (? - ? days) |
| P-864099480 | 95 | As is | in stock |
| P-878240387 | 98 | As is | in stock |
| P-851290704 | 95 | As is | by synthesis |
| P-868581007 | 95 | As is | in stock |
| P-580403049 | 95 | As is | by resynthesis (? - ? days) |
| P-890215321 | 90 | As is | in stock |
| P-590337754 | 90 | As is | 1000 mg |
| P-500157653 | 96 | As is | in stock |
| P-563505554 | 95 | As is | 5 g |
| P-613278806 | 95 | As is | by synthesis |
| P-580513951 | 95 | As is | 2 g |
| P-854759734 | 95 | As is | by synthesis |
| P-859992944 | 95 | As is | by synthesis |
| P-502372400 | 90 | As is | in stock |
| P-611350428 | 90 | As is | in stock |
| P-854644542 | 95 | As is | in stock |
| P-867636929 | 95 | As a main component | in stock |
| P-875802272 | N/A | As a main component | in stock |
| P-894627923 | 95 | As a main component | in stock |
| P-613850336 | 95 | As a main component | in stock |
| P-903157232 | 96 | As a main component | 10 g |
| P-610979355 | 90 | As a main component | 93.094 g |
| P-851436435 | N/A | As a main component | by synthesis |
| P-606916938 | N/A | As a main component | in stock |
| P-489235425 | 97 | As a main component | in stock |
| P-597004200 | 95 | As a main component | 4 g |
| P-895932264 | 95 | As a main component | by resynthesis (? - ? days) |
| P-864099481 | 95 | As a main component | in stock |
| P-611014163 | 95 | As a main component | by synthesis |
| P-901424646 | 95 | As a main component | by synthesis |
| P-617650869 | 90 | As a main component | in stock |
| P-619331540 | 90 | As a main component | 5.195 g |
| P-584600267 | 95 | As a main component | in stock |
| P-617265616 | 90 | As a main component | in stock |
| P-861462025 | 95 | As a main component | by synthesis |
| P-862027257 | 95 | As a main component | 5.595 g |
| P-563505555 | 95 | As a main component | 5 g |
| P-579641662 | 95 | As a main component | by resynthesis (? - ? days) |
| P-852428926 | N/A | As a main component | in stock |
| P-854942313 | 95 | As a main component | by synthesis |
| P-854723127 | 95 | As a main component | in stock |
| P-596788608 | 95 | As a main component | 12.7 g |
| P-903981299 | 94 | As a main component | by resynthesis (? - ? days) |
| P-611350429 | 90 | As a main component | in stock |
| P-615422231 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 157.210 |
| logP | 1.1796 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 49.33 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 46.9445 |
| Atoms | 26 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 15 |
| 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 |
