Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5792188030
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 | 25 USD | 98 | 20 working days | Get Quote |
| 5 mg | 25 USD | 98 | 20 working days | Get Quote |
| 10 mg | 25 USD | 98 | 20 working days | Get Quote |
- 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-2616317234
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5792188030.sdf |
| SMILES | MCULE-5792188030.smiles |
| Standard InChI | MCULE-5792188030.inchi |
| InChIKey | MCULE-5792188030.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-608080621 | 95 | As is | in stock |
| P-852559326 | N/A | As is | by synthesis |
| P-895720564 | 95 | As is | by synthesis |
| P-867605149 | 95 | Main component | in stock |
| P-875763071 | 95 | Main component | in stock |
| P-613849540 | 95 | Main component | by resynthesis (? - ? days) |
| P-903099842 | 98 | Main component | 10 g |
| P-1270407034 | 95 | Main component | in stock |
| P-580264923 | 95 | Main component | by synthesis |
| P-617059052 | 95 | Main component | by resynthesis (? - ? days) |
| P-606892529 | N/A | Main component | in stock |
| P-873292149 | 98 | Main component | 6 g |
| P-1273449744 | 95 | Main component | by resynthesis (? - ? days) |
| P-889782334 | 95 | Main component | in stock |
| P-492250083 | 95 | Main component | in stock |
| P-454737584 | 90 | Main component | in stock |
| P-436477718 | 95 | Main component | in stock |
| P-851288697 | 95 | Main component | by synthesis |
| P-868618814 | 98 | Main component | in stock |
| P-905343513 | 98 | Main component | 2 g |
| P-862021368 | 98 | Main component | 15.65 g |
| P-579522436 | 90 | Main component | 1 mg |
| P-890211270 | 90 | Main component | in stock |
| P-675213863 | 95 | Main component | in stock |
| P-502550254 | 95 | Main component | by synthesis |
| P-500153240 | 96 | Main component | in stock |
| P-524174936 | 95 | Main component | unavailable |
| P-596548122 | 95 | Main component | unavailable |
| P-856077842 | 95 | Main component | in stock |
| P-852497210 | 95 | Main component | by synthesis |
| P-895222511 | 95 | Main component | in stock |
| P-906833832 | 98 | Main component | by synthesis |
| P-611476416 | 90 | Main component | in stock |
| P-610979776 | 90 | Main component as a main component | 158.391 g |
| P-889492797 | 95 | Main component as a main component | by synthesis |
| P-860797557 | 95 | Main component as a main component | in stock |
| P-1271500177 | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 180.674 |
| logP | 0.6688 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 24.5 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 51.3117 |
| Atoms | 28 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 17 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
