Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9505315818-0
Structure
Show compound
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 | 14 USD | 97 | 14 working days | Get Quote |
| 5 mg | 14 USD | 97 | 14 working days | Get Quote |
| 10 mg | 14 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-6304035304-0
- Component type: Main
-
2
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9505315818-0.sdf |
| SMILES | MCULE-9505315818-0.smiles |
| Standard InChI | MCULE-9505315818-0.inchi |
| InChIKey | MCULE-9505315818-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886588019 | 95 | As is | in stock |
| P-1274636318 | 95 | As is | in stock |
| P-595207678 | 95 | As is | by resynthesis (? - ? days) |
| P-610896661 | 90 | As is | by synthesis |
| P-851562849 | N/A | As is | by synthesis |
| P-489215639 | 97 | As is | in stock |
| P-889461467 | 95 | As is | by synthesis |
| P-590818249 | 95 | As is | by synthesis |
| P-901449231 | 95 | As is | by synthesis |
| P-851241672 | 95 | As is | by synthesis |
| P-861558656 | 95 | As is | by synthesis |
| P-888313452 | N/A | As is | in stock |
| P-891668808 | 95 | As is | by synthesis |
| P-852461848 | 95 | As is | by synthesis |
| P-854841647 | 95 | As is | by synthesis |
| P-611487588 | 90 | As is | in stock |
| P-893813063 | 85 | As is | by synthesis |
| P-867547251 | 98 | Main component | in stock |
| P-875704307 | 98 | Main component | in stock |
| P-590383566 | 95 | Main component | by resynthesis (? - ? days) |
| P-903029298 | 97 | Main component | 200 g |
| P-610953227 | 90 | Main component | 405.54 g |
| P-901165608 | 98 | Main component | in stock |
| P-1270379814 | 98 | Main component | in stock |
| P-870664445 | N/A | Main component | in stock |
| P-489171935 | 97 | Main component | in stock |
| P-596978482 | 98 | Main component | 27.39 g |
| P-589662222 | 95 | Main component | by resynthesis (? - ? days) |
| P-864118442 | 95 | Main component | in stock |
| P-851241671 | 95 | Main component | by synthesis |
| P-868648209 | 98 | Main component | in stock |
| P-580296672 | 95 | Main component | by resynthesis (? - ? days) |
| P-861982467 | 98 | Main component | 199.86 g |
| P-1264340131 | 98 | Main component | 2 g |
| P-579522401 | 90 | Main component | 2 g |
| P-890211235 | 90 | Main component | in stock |
| P-526220893 | 90 | Main component | in stock |
| P-500163336 | 96 | Main component | in stock |
| P-454353604 | 90 | Main component | 984 mg |
| P-608081885 | 95 | Main component | in stock |
| P-1273201386 | 95 | Main component | 1000 mg |
| P-25840445 | 95 | Main component | 644 mg |
| P-580483593 | N/A | Main component | by synthesis |
| P-1272577637 | 95 | Main component | 100 g |
| P-852437508 | 95 | Main component | by synthesis |
| P-865619738 | 95 | Main component | in stock |
| P-888859184 | N/A | Main component | in stock |
| P-859988725 | 95 | Main component | by synthesis |
| P-613806669 | 95 | Main component | in stock |
| P-502360531 | 90 | Main component | in stock |
| P-1272896080 | 94 | Main component | by resynthesis (? - ? days) |
| P-611484633 | 90 | Main component | in stock |
| P-1271726341 | 95 | Main component | in stock |
| P-1266010548 | 96 | Main component as a main component | in stock |
| P-889901824 | N/A | Main component as a main component | by synthesis |
| P-890252061 | 97 | Main component as a main component | by synthesis |
| P-595217442 | 98 | Main component as a main component | by resynthesis (? - ? days) |
| P-580246782 | 95 | Main component as a main component | by synthesis |
| P-851762984 | N/A | Main component as a main component | by synthesis |
| P-851882199 | N/A | Main component as a main component | by synthesis |
| P-489226251 | 97 | Main component as a main component | in stock |
| P-864108380 | 95 | Main component as a main component | in stock |
| P-591072071 | 96 | Main component as a main component | by synthesis |
| P-591130753 | 95 | Main component as a main component | by synthesis |
| P-868604578 | 96 | Main component as a main component | in stock |
| P-563404251 | 95 | Main component as a main component | 250 mg |
| P-854836483 | 95 | Main component as a main component | by synthesis |
| P-611534245 | 90 | Main component as a main component | in stock |
| P-886945728 | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 211.086 |
| logP | 2.8532 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 48.14 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 52.3324 |
| Atoms | 24 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 12 |
| Heteroatoms | 5 |
| N/O atoms | 3 |
| 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 |
