MCULE-1041352868
- 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 | 7 USD | 98 | 14 working days | Get Quote |
| 5 mg | 7 USD | 98 | 14 working days | Get Quote |
| 10 mg | 7 USD | 98 | 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-3100708663
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1041352868.sdf |
| SMILES | MCULE-1041352868.smiles |
| Standard InChI | MCULE-1041352868.inchi |
| InChIKey | MCULE-1041352868.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867534100 | 98 | As is | in stock |
| P-875689086 | N/A | As is | in stock |
| P-588247365 | 98 | As is | in stock |
| P-903007752 | 98 | As is | 600 g |
| P-489176220 | 97 | As is | in stock |
| P-596981433 | 98 | As is | 600 g |
| P-864195492 | 95 | As is | in stock |
| P-901458102 | 95 | As is | by synthesis |
| P-901458329 | 95 | As is | by synthesis |
| P-619331631 | 90 | As is | 551 mg |
| P-615655451 | 95 | As is | in stock |
| P-579622502 | 95 | As is | unavailable |
| P-31161663 | 90 | As is | 2 g |
| P-856042862 | 90 | As is | 2 g |
| P-580473864 | N/A | As is | by synthesis |
| P-871238981 | N/A | As is | by synthesis |
| P-852379056 | N/A | As is | in stock |
| P-885543516 | 95 | As is | by synthesis |
| P-904097718 | 97 | As is | 908.02 g |
| P-873035044 | 90 | As is | 1000 mg |
| P-906751751 | 98 | As is | by synthesis |
| P-611461691 | 90 | As is | in stock |
| P-611377132 | 90 | As is | in stock |
| P-886922051 | 95 | As is | by synthesis |
| P-867534101 | 95 | Main component | in stock |
| P-875689087 | N/A | Main component | in stock |
| P-580454693 | 95 | Main component | in stock |
| P-869181743 | 95 | Main component | in stock |
| P-505393216 | 98 | Main component | in stock |
| P-903007753 | 97 | Main component | 3 kg |
| P-489116223 | 97 | Main component | in stock |
| P-596986129 | 97 | Main component | 1000 g |
| P-864110610 | 95 | Main component | in stock |
| P-889740506 | 95 | Main component | 100 g |
| P-901458081 | 95 | Main component | by synthesis |
| P-878239796 | 98 | Main component | in stock |
| P-868554530 | 98 | Main component | in stock |
| P-580421017 | 95 | Main component | by resynthesis (? - ? days) |
| P-590341416 | 90 | Main component | 10 g |
| P-890218970 | 90 | Main component | in stock |
| P-505526739 | 95 | Main component | in stock |
| P-492217384 | 95 | Main component | in stock |
| P-488554140 | 90 | Main component | in stock |
| P-579629957 | 95 | Main component | by resynthesis (? - ? days) |
| P-856042861 | 90 | Main component | unavailable |
| P-31161026 | 90 | Main component | unavailable |
| P-613281588 | 95 | Main component | by synthesis |
| P-852458450 | N/A | Main component | in stock |
| P-621105302 | 90 | Main component | by synthesis |
| P-620215602 | 95 | Main component | 1000 mg |
| P-12391312 | 90 | Main component | 1000 mg |
| P-454374683 | 92 | Main component | in stock |
| P-859995234 | 95 | Main component | by synthesis |
| P-519858706 | 90 | Main component | in stock |
| P-502335710 | 90 | Main component | in stock |
| P-22510383 | 90 | Main component | 1000 mg |
| P-611493035 | 90 | Main component | in stock |
| P-855031369 | 90 | Main component | in stock |
| P-480884016 | 95 | Main component | in stock |
| P-867645965 | 98 | Main component as a main component | in stock |
| P-875813122 | N/A | Main component as a main component | in stock |
| P-904061901 | 95 | Main component as a main component | by synthesis |
| P-611491691 | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 216.681 |
| logP | 2.4311 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 15.27 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 64.7237 |
| Atoms | 28 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 14 |
| Heteroatoms | 4 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |

