Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9739174348
Compound
Show structure
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 | 27 USD | 95 | 12 working days | Get Quote |
| 5 mg | 44 USD | 95 | 12 working days | Get Quote |
| 10 mg | 81 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-1204198266
- Component type: Main
-
2
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9739174348.sdf |
| SMILES | MCULE-9739174348.smiles |
| Standard InChI | MCULE-9739174348.inchi |
| InChIKey | MCULE-9739174348.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867634250 | 98 | As is | in stock |
| P-875799013 | 98 | As is | in stock |
| P-613846745 | 95 | As is | by resynthesis (? - ? days) |
| P-893607420 | 90 | As is | 696 mg |
| P-1270359928 | 98 | As is | in stock |
| P-901179161 | N/A | As is | in stock |
| P-895100690 | N/A | As is | 200 mg |
| P-1273262925 | 95 | As is | by resynthesis (? - ? days) |
| P-904977586 | 95 | As is | by synthesis |
| P-901917269 | 98 | As is | 238 mg |
| P-1263265456 | 95 | As is | by synthesis |
| P-888622862 | 95 | As is | 1 mg |
| P-874445691 | 95 | As is | in stock |
| P-875882445 | 95 | As is | in stock |
| P-892294049 | 95 | As is | unavailable |
| P-869159300 | 95 | As is | 978 mg |
| P-888654895 | 95 | As is | 973 mg |
| P-1271617869 | 98 | As is | in stock |
| P-867646295 | N/A | Main component | in stock |
| P-875813238 | N/A | Main component | in stock |
| P-613846741 | 95 | Main component | by resynthesis (? - ? days) |
| P-893607419 | 90 | Main component | 899 mg |
| P-881621208 | N/A | Main component | by synthesis |
| P-895102436 | 98 | Main component | 500 mg |
| P-1273475270 | 95 | Main component | by resynthesis (? - ? days) |
| P-1275488297 | 95 | Main component | in stock |
| P-890229151 | 98 | Main component | by synthesis |
| P-1263254942 | 95 | Main component | by synthesis |
| P-888622861 | 95 | Main component | 5 mg |
| P-895192453 | 95 | Main component | by synthesis |
| P-892294048 | 95 | Main component | unavailable |
| P-869159299 | 95 | Main component | 100 mg |
| P-888654894 | 95 | Main component | 100 mg |
| P-1271627023 | 99 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 360.318 |
| logP | 4.9771 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 9 |
| PSA | 30.29 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 100.531 |
| Atoms | 50 |
| Rings | 2 |
| Heavy atoms | 23 |
| Hydrogen atoms | 27 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| 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 |
