MCULE-8684474701-0
- 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 | 31 USD | 95 | 12 working days | Get Quote |
| 5 mg | 31 USD | 95 | 12 working days | Get Quote |
| 10 mg | 31 USD | 95 | 12 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-9925925283-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8684474701-0.sdf |
| SMILES | MCULE-8684474701-0.smiles |
| Standard InChI | MCULE-8684474701-0.inchi |
| InChIKey | MCULE-8684474701-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886628827 | 95 | As is | in stock |
| P-875812653 | N/A | As is | in stock |
| P-903173641 | 98 | As is | 5 g |
| P-875906285 | N/A | As is | in stock |
| P-489197993 | 97 | As is | in stock |
| P-875890924 | 98 | As is | 2 g |
| P-889780598 | 95 | As is | in stock |
| P-873438426 | 98 | As is | 2.2 g |
| P-861397205 | 95 | As is | by synthesis |
| P-563465136 | 95 | As is | 1000 mg |
| P-854865188 | 95 | As is | by synthesis |
| P-870986858 | 90 | As is | 280 mg |
| P-500398953 | 98 | As is | by synthesis |
| P-906830362 | 98 | As is | by synthesis |
| P-906867501 | 98 | As is | by synthesis |
| P-906867502 | 99 | As is | by synthesis |
| P-906863259 | 98 | As is | by synthesis |
| P-894004615 | 95 | As is | in stock |
| P-612881155 | 99 | Main component | by synthesis |
| P-889911971 | N/A | Main component | by synthesis |
| P-874607576 | 95 | Main component | in stock |
| P-590386348 | 95 | Main component | in stock |
| P-903099980 | 95 | Main component | 4 g |
| P-610980215 | 90 | Main component | 153.982 g |
| P-851925298 | N/A | Main component | in stock |
| P-489151139 | 97 | Main component | in stock |
| P-596932222 | 95 | Main component | 20 g |
| P-579785114 | 95 | Main component | by resynthesis (? - ? days) |
| P-864109859 | 95 | Main component | in stock |
| P-900268728 | N/A | Main component | by resynthesis (? - ? days) |
| P-577179841 | 90 | Main component | by synthesis |
| P-851280882 | 95 | Main component | by synthesis |
| P-868595059 | 98 | Main component | in stock |
| P-580300437 | 95 | Main component | by resynthesis (? - ? days) |
| P-862071763 | 95 | Main component | 29.982 g |
| P-502573410 | 95 | Main component | by synthesis |
| P-524186880 | 97 | Main component | 1000 mg |
| P-596566629 | 95 | Main component | 5 g |
| P-524186831 | 97 | Main component | 5 g |
| P-615656708 | 95 | Main component | in stock |
| P-580487987 | N/A | Main component | by synthesis |
| P-852604914 | N/A | Main component | in stock |
| P-901008984 | 95 | Main component | in stock |
| P-620223803 | 95 | Main component | 1000 mg |
| P-620069079 | 90 | Main component | 1000 mg |
| P-878262526 | 98 | Main component | in stock |
| P-500398824 | 97 | Main component | by synthesis |
| P-885538231 | 95 | Main component | by synthesis |
| P-519923107 | 90 | Main component | in stock |
| P-873224011 | 90 | Main component | in stock |
| P-906865799 | 99 | Main component | by synthesis |
| P-611441747 | 90 | Main component | in stock |
| P-2517015 | 90 | Main component | 8 mg |
| P-893940116 | 95 | Main component | in stock |
| P-893936817 | 95 | Main component | in stock |
| P-615413312 | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 153.606 |
| logP | 1.7007 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 37.6312 |
| Atoms | 21 |
| Rings | 0 |
| Heavy atoms | 9 |
| Hydrogen atoms | 12 |
| 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 |

