MCULE-7495263628
- 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 | 11 USD | 95 | 22 working days | Get Quote |
| 5 mg | 11 USD | 95 | 22 working days | Get Quote |
| 10 mg | 11 USD | 95 | 22 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-8487399623
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7495263628.sdf |
| SMILES | MCULE-7495263628.smiles |
| Standard InChI | MCULE-7495263628.inchi |
| InChIKey | MCULE-7495263628.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-872837361 | 95 | As is | in stock |
| P-875855997 | 95 | As is | in stock |
| P-892792429 | 95 | As is | by resynthesis (? - ? days) |
| P-903302530 | N/A | As is | 200 mg |
| P-610995069 | 90 | As is | 5.9 g |
| P-606903578 | N/A | As is | in stock |
| P-865931729 | 95 | As is | 500 mg |
| P-1273261509 | 95 | As is | by resynthesis (? - ? days) |
| P-872697199 | 95 | As is | in stock |
| P-868957974 | 95 | As is | by synthesis |
| P-901558489 | 95 | As is | by synthesis |
| P-861364462 | 95 | As is | by synthesis |
| P-608498323 | 95 | As is | in stock |
| P-855924325 | 97 | As is | 5 mg |
| P-895191695 | 95 | As is | by synthesis |
| P-584625180 | 95 | As is | in stock |
| P-888171848 | 98 | As is | by synthesis |
| P-892294708 | 95 | As is | unavailable |
| P-869160640 | 95 | As is | 150 mg |
| P-888655893 | 95 | As is | 150 mg |
| P-596714556 | 90 | As is | 40 mg |
| P-868503771 | 98 | As is | in stock |
| P-867680141 | N/A | Main component | in stock |
| P-875859121 | N/A | Main component | in stock |
| P-892791273 | 95 | Main component | by resynthesis (? - ? days) |
| P-903312348 | 98 | Main component | 600 mg |
| P-1264053192 | 99 | Main component | in stock |
| P-610984648 | 90 | Main component | 29.776 g |
| P-1270338568 | 98 | Main component | in stock |
| P-1264201516 | N/A | Main component | by synthesis |
| P-865932203 | 98 | Main component | 10 mg |
| P-1273451329 | 95 | Main component | by resynthesis (? - ? days) |
| P-864190790 | 95 | Main component | in stock |
| P-1264192506 | 98 | Main component | by synthesis |
| P-901502994 | 95 | Main component | by synthesis |
| P-861378103 | 95 | Main component | by synthesis |
| P-579482104 | 95 | Main component | in stock |
| P-901410689 | 98 | Main component | 10 mg |
| P-855927411 | 97 | Main component | 5 mg |
| P-854718661 | 95 | Main component | in stock |
| P-1272502966 | 95 | Main component | by synthesis |
| P-888171607 | 98 | Main component | by synthesis |
| P-617404231 | 98 | Main component | in stock |
| P-873286307 | N/A | Main component | in stock |
| P-892294720 | 95 | Main component | unavailable |
| P-869160668 | 95 | Main component | 88 mg |
| P-888655920 | 95 | Main component | 188 mg |
| P-886930805 | 98 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 324.844 |
| logP | 3.7265 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 55.56 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 93.8399 |
| Atoms | 47 |
| Rings | 3 |
| Heavy atoms | 22 |
| Hydrogen atoms | 25 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |

