Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5326797991
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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 25 USD | 95 | 21 working days | Get Quote |
| 10 mg | 25 USD | 95 | 21 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-2044272330
- Component type: Main
-
1
MCULE-1504889908
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5326797991.sdf |
| SMILES | MCULE-5326797991.smiles |
| Standard InChI | MCULE-5326797991.inchi |
| InChIKey | MCULE-5326797991.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867521056 | N/A | As is | by synthesis |
| P-901549574 | 95 | As is | by synthesis |
| P-488553891 | 90 | As is | in stock |
| P-613276003 | 95 | As is | by synthesis |
| P-622582775 | 90 | As is | by synthesis |
| P-855249322 | 90 | As is | in stock |
| P-875729068 | N/A | Main component | in stock |
| P-505394879 | 98 | Main component | in stock |
| P-873287136 | 94 | Main component | in stock |
| P-901413740 | 95 | Main component | in stock |
| P-454645529 | 90 | Main component | in stock |
| P-10539542 | 90 | Main component | 1.4 kg |
| P-580304589 | 95 | Main component | by resynthesis (? - ? days) |
| P-502533053 | 95 | Main component | by synthesis |
| P-856044322 | 90 | Main component | 10 g |
| P-31274424 | 90 | Main component | 10 g |
| P-852406344 | N/A | Main component | in stock |
| P-13009248 | 90 | Main component | 106 mg |
| P-617707418 | 95 | Main component | 106 mg |
| P-500384356 | 98 | Main component | by synthesis |
| P-885516470 | 95 | Main component | by synthesis |
| P-19082029 | 90 | Main component | in stock |
| P-502368286 | 90 | Main component | in stock |
| P-611373802 | 90 | Main component | in stock |
| P-3230118 | 90 | Main component | 3.494 g |
| P-1115819 | 90 | Main component | 3.494 g |
| P-867585636 | 95 | Main component as a main component | in stock |
| P-875743643 | N/A | Main component as a main component | in stock |
| P-893571388 | 90 | Main component as a main component | 63 g |
| P-869389918 | 95 | Main component as a main component | in stock |
| P-893251358 | 95 | Main component as a main component | by synthesis |
| P-34740332 | 90 | Main component as a main component | in stock |
| P-488549415 | 90 | Main component as a main component | in stock |
| P-24435794 | 95 | Main component as a main component | 300 mg |
| P-905454576 | 95 | Main component as a main component | by synthesis |
| P-591358585 | 90 | Main component as a main component | by synthesis |
| P-26464487 | 90 | Main component as a main component | 76 mg |
| P-14027632 | 92 | Main component as a main component | 300 mg |
| P-502385851 | 90 | Main component as a main component | in stock |
| P-855294924 | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 282.318 |
| logP | 4.1084 |
| H-bond acceptors | 6 |
| H-bond donors | 4 |
| Rotatable bonds | 1 |
| PSA | 135.02 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 74.9084 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 19 |
| Hydrogen atoms | 14 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| 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 |
