MCULE-3598056685-1
- 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 | 5 USD | 95 | 14 working days | Get Quote |
| 5 mg | 5 USD | 95 | 14 working days | Get Quote |
| 10 mg | 5 USD | 95 | 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-3875249601-1
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3598056685-1.sdf |
| SMILES | MCULE-3598056685-1.smiles |
| Standard InChI | MCULE-3598056685-1.inchi |
| InChIKey | MCULE-3598056685-1.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867585622 | 98 | As is | in stock |
| P-875743440 | N/A | As is | in stock |
| P-580453852 | 98 | As is | in stock |
| P-874648265 | 95 | As is | in stock |
| P-903074228 | 95 | As is | 200 g |
| P-905490325 | 98 | As is | 100 g |
| P-606860249 | N/A | As is | in stock |
| P-489215833 | 97 | As is | in stock |
| P-596931509 | 95 | As is | 1.5 kg |
| P-895923235 | 95 | As is | by resynthesis (? - ? days) |
| P-864122034 | 97 | As is | in stock |
| P-901144810 | 95 | As is | 23 g |
| P-580707157 | 98 | As is | 656 g |
| P-901520107 | 95 | As is | by synthesis |
| P-616235040 | 90 | As is | 5 mg |
| P-617652345 | 90 | As is | in stock |
| P-617651766 | 90 | As is | in stock |
| P-619826742 | 90 | As is | 41 mg |
| P-584604476 | 95 | As is | 17 g |
| P-617323520 | 90 | As is | in stock |
| P-868604470 | 98 | As is | in stock |
| P-34741414 | 90 | As is | in stock |
| P-580780739 | 90 | As is | by resynthesis (? - ? days) |
| P-580769807 | 90 | As is | in stock |
| P-905343290 | 95 | As is | 165 g |
| P-862020769 | 95 | As is | 2.41179 kg |
| P-896535458 | 95 | As is | 1000 mg |
| P-870646477 | 99 | As is | in stock |
| P-870646550 | N/A | As is | in stock |
| P-675477679 | 90 | As is | in stock |
| P-675513921 | 95 | As is | in stock |
| P-524167683 | 98 | As is | 100 g |
| P-579633752 | 98 | As is | by resynthesis (? - ? days) |
| P-31177505 | 90 | As is | unavailable |
| P-856042377 | 90 | As is | unavailable |
| P-612220694 | 90 | As is | 186 mg |
| P-612232059 | 95 | As is | 186 mg |
| P-580482105 | N/A | As is | by synthesis |
| P-852504994 | N/A | As is | in stock |
| P-854741376 | 95 | As is | in stock |
| P-492279557 | 95 | As is | 5 g |
| P-34030365 | 90 | As is | 484 mg |
| P-675089087 | 90 | As is | in stock |
| P-906898855 | 97 | As is | in stock |
| P-906760563 | 98 | As is | by synthesis |
| P-893963664 | 95 | As is | in stock |
| P-867624611 | 98 | Main component | in stock |
| P-875787202 | N/A | Main component | in stock |
| P-869201944 | 95 | Main component | in stock |
| P-904335049 | 90 | Main component | 225 g |
| P-606877078 | N/A | Main component | in stock |
| P-489190518 | 97 | Main component | in stock |
| P-481171316 | 95 | Main component | 8.75 g |
| P-590612015 | 98 | Main component | 1000 mg |
| P-851270406 | 95 | Main component | by synthesis |
| P-868623977 | 98 | Main component | in stock |
| P-580428768 | 95 | Main component | by resynthesis (? - ? days) |
| P-579522990 | 90 | Main component | 1 mg |
| P-890211800 | 90 | Main component | in stock |
| P-900956257 | 95 | Main component | in stock |
| P-524186210 | 97 | Main component | 5 g |
| P-852483889 | N/A | Main component | in stock |
| P-502339959 | 90 | Main component | in stock |
| P-611572373 | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 201.648 |
| logP | 2.3617 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 52.32 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 51.9794 |
| Atoms | 25 |
| Rings | 1 |
| Heavy atoms | 13 |
| 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 |

