Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2445860551
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 | 79 USD | 90 | 22 working days | Get Quote |
| 5 mg | 114 USD | 90 | 22 working days | Get Quote |
| 10 mg | 124 USD | 95 | 22 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-7166348416
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2445860551.sdf |
| SMILES | MCULE-2445860551.smiles |
| Standard InChI | MCULE-2445860551.inchi |
| InChIKey | MCULE-2445860551.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867616281 | 95 | As is | in stock |
| P-875777006 | N/A | As is | in stock |
| P-590354944 | 95 | As is | in stock |
| P-903120511 | 97 | As is | 1000 mg |
| P-893519015 | 90 | As is | 48.75 g |
| P-851773530 | N/A | As is | by synthesis |
| P-873293177 | 97 | As is | 2 g |
| P-889800860 | 95 | As is | by synthesis |
| P-590986756 | 95 | As is | by synthesis |
| P-901434840 | 95 | As is | by synthesis |
| P-616226824 | 95 | As is | in stock |
| P-4145893 | 90 | As is | 5 mg |
| P-868573638 | 98 | As is | in stock |
| P-855947863 | 95 | As is | 5 g |
| P-852394879 | N/A | As is | in stock |
| P-874440225 | 95 | As is | by synthesis |
| P-502385370 | 90 | As is | in stock |
| P-868517626 | 95 | As is | in stock |
| P-886615554 | 95 | Main component | in stock |
| P-889928900 | N/A | Main component | by synthesis |
| P-907006597 | 95 | Main component | in stock |
| P-903155995 | 95 | Main component | 5 g |
| P-893582912 | 90 | Main component | 77.55 g |
| P-606928182 | N/A | Main component | in stock |
| P-889589402 | 95 | Main component | in stock |
| P-878240681 | 98 | Main component | in stock |
| P-861478848 | 95 | Main component | by synthesis |
| P-580392733 | N/A | Main component | by resynthesis (? - ? days) |
| P-888890030 | N/A | Main component | in stock |
| P-611558061 | 90 | Main component | in stock |
| P-886902649 | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 149.660 |
| logP | 2.7314 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 12.03 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 43.4157 |
| Atoms | 25 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 16 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
