Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2491423827
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 | 20 USD | 98 | 22 working days | Get Quote |
| 5 mg | 28 USD | 98 | 16 working days | Get Quote |
| 10 mg | 34 USD | 98 | 16 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.
| Name | File |
|---|---|
| SDF | MCULE-2491423827.sdf |
| SMILES | MCULE-2491423827.smiles |
| Standard InChI | MCULE-2491423827.inchi |
| InChIKey | MCULE-2491423827.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867633674 | 98 | As is | in stock |
| P-875799081 | N/A | As is | in stock |
| P-869185116 | 95 | As is | in stock |
| P-505399678 | 98 | As is | in stock |
| P-903153888 | 98 | As is | 7 g |
| P-893472626 | 90 | As is | 44.122 g |
| P-580234559 | 95 | As is | by synthesis |
| P-606909687 | N/A | As is | in stock |
| P-489158509 | 97 | As is | in stock |
| P-596967202 | 98 | As is | 3 g |
| P-605394345 | 95 | As is | by resynthesis (? - ? days) |
| P-864114889 | 95 | As is | in stock |
| P-860056108 | 98 | As is | by synthesis |
| P-868544439 | 99 | As is | in stock |
| P-580696809 | 98 | As is | 425 mg |
| P-901454104 | 95 | As is | by synthesis |
| P-893361894 | 90 | As is | 1000 mg |
| P-454685192 | 90 | As is | in stock |
| P-584554103 | 90 | As is | 28 mg |
| P-881634190 | 98 | As is | in stock |
| P-436443400 | 90 | As is | 89.93 g |
| P-176438 | 90 | As is | 481 mg |
| P-851242974 | 95 | As is | by synthesis |
| P-860799466 | 98 | As is | in stock |
| P-580452755 | 98 | As is | in stock |
| P-861490424 | 95 | As is | by synthesis |
| P-34688131 | 90 | As is | by synthesis |
| P-580787961 | 90 | As is | by resynthesis (? - ? days) |
| P-579479009 | 95 | As is | in stock |
| P-580277807 | 95 | As is | by resynthesis (? - ? days) |
| P-675216101 | 95 | As is | in stock |
| P-873242597 | 97 | As is | 5 mg |
| P-873242596 | 95 | As is | 5 mg |
| P-579693711 | 95 | As is | by resynthesis (? - ? days) |
| P-852494946 | N/A | As is | in stock |
| P-1263153348 | 95 | As is | by synthesis |
| P-854717539 | 95 | As is | in stock |
| P-474026651 | 95 | As is | in stock |
| P-871075233 | 95 | As is | in stock |
| P-608275542 | 98 | As is | in stock |
| P-26525970 | 90 | As is | 3 mg |
| P-24038475 | 90 | As is | in stock |
| P-579710259 | N/A | As is | in stock |
| P-589631372 | N/A | As is | in stock |
| P-464646827 | 95 | As is | by synthesis |
| P-892296770 | 95 | As is | 950 mg |
| P-888657278 | 95 | As is | 950 mg |
| P-33494727 | 90 | As is | in stock |
| P-502337489 | 90 | As is | in stock |
| P-22523062 | 90 | As is | 30 mg |
| P-1403876 | 90 | As is | 120 mg |
| P-480967830 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 248.706 |
| logP | 3.4268 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 58.88 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 68.4551 |
| Atoms | 30 |
| Rings | 3 |
| Heavy atoms | 17 |
| Hydrogen atoms | 13 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
