Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5834866049
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 | 6 USD | 97 | 14 working days | Get Quote |
| 5 mg | 6 USD | 97 | 14 working days | Get Quote |
| 10 mg | 6 USD | 97 | 14 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-3824190231
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5834866049.sdf |
| SMILES | MCULE-5834866049.smiles |
| Standard InChI | MCULE-5834866049.inchi |
| InChIKey | MCULE-5834866049.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867613995 | 98 | As is | in stock |
| P-875774188 | 98 | As is | in stock |
| P-590413840 | 95 | As is | by resynthesis (? - ? days) |
| P-903114746 | 98 | As is | 40 g |
| P-875893392 | 95 | As is | in stock |
| P-1263092170 | N/A | As is | by synthesis |
| P-596963176 | N/A | As is | 40 g |
| P-1273472926 | 95 | As is | by resynthesis (? - ? days) |
| P-864170506 | 95 | As is | in stock |
| P-890229333 | 95 | As is | by synthesis |
| P-901506494 | 95 | As is | by synthesis |
| P-868626935 | 95 | As is | in stock |
| P-862141051 | 98 | As is | 40 g |
| P-524179372 | 95 | As is | 1000 mg |
| P-872721800 | N/A | As is | by synthesis |
| P-854803819 | 95 | As is | by synthesis |
| P-596763715 | 95 | As is | 24 g |
| P-906791914 | 95 | As is | by synthesis |
| P-611363068 | 90 | As is | in stock |
| P-615655952 | 95 | As is | unavailable |
| P-1271628161 | 98 | As is | in stock |
| P-867661944 | 95 | Main component | in stock |
| P-875831086 | 95 | Main component | in stock |
| P-590386554 | 95 | Main component | by resynthesis (? - ? days) |
| P-903206518 | 97 | Main component | 25 g |
| P-893519537 | 90 | Main component | 609.54 g |
| P-1270398238 | 97 | Main component | in stock |
| P-580254604 | 95 | Main component | by synthesis |
| P-617059775 | 95 | Main component | by resynthesis (? - ? days) |
| P-606852928 | N/A | Main component | in stock |
| P-489110867 | 97 | Main component | in stock |
| P-596972992 | 98 | Main component | 500 g |
| P-494347460 | 95 | Main component | 47.7 g |
| P-864174711 | 97 | Main component | in stock |
| P-580695860 | 97 | Main component | 31.1 g |
| P-868580059 | 97 | Main component | in stock |
| P-905346574 | 95 | Main component | 31 g |
| P-862031217 | 95 | Main component | 41.542 g |
| P-454409932 | 95 | Main component | 6 mg |
| P-18801452 | 95 | Main component | 6 mg |
| P-579692545 | 95 | Main component | by resynthesis (? - ? days) |
| P-580506658 | N/A | Main component | by synthesis |
| P-1272572884 | 95 | Main component | 250 mg |
| P-852413932 | 95 | Main component | by synthesis |
| P-35238665 | 90 | Main component | in stock |
| P-854747823 | 95 | Main component | in stock |
| P-885517101 | 95 | Main component | by synthesis |
| P-596767238 | 95 | Main component | 71.9 g |
| P-502396065 | 90 | Main component | in stock |
| P-906782414 | 99 | Main component | by synthesis |
| P-611363067 | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 223.482 |
| logP | 3.6717 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 28.68 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 53.0787 |
| Atoms | 17 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 5 |
| Heteroatoms | 5 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
