Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9618213849
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 | 28 USD | 95 | 22 working days | Get Quote |
| 5 mg | 28 USD | 95 | 22 working days | Get Quote |
| 10 mg | 28 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-8438883094
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9618213849.sdf |
| SMILES | MCULE-9618213849.smiles |
| Standard InChI | MCULE-9618213849.inchi |
| InChIKey | MCULE-9618213849.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886535897 | 95 | As is | in stock |
| P-1268856398 | 95 | As is | by synthesis |
| P-853442308 | 95 | As is | by resynthesis (? - ? days) |
| P-903040324 | 98 | As is | 900 mg |
| P-893593186 | 90 | As is | 40.647 g |
| P-1270375171 | 98 | As is | in stock |
| P-851484077 | N/A | As is | by synthesis |
| P-489219372 | 97 | As is | in stock |
| P-596991816 | 98 | As is | 900 mg |
| P-1273402350 | 95 | As is | by resynthesis (? - ? days) |
| P-864116644 | 95 | As is | in stock |
| P-590770093 | 98 | As is | by synthesis |
| P-851246549 | 95 | As is | by synthesis |
| P-893635361 | 95 | As is | by synthesis |
| P-580428181 | 95 | As is | by resynthesis (? - ? days) |
| P-862019526 | 98 | As is | 900 mg |
| P-563520946 | 95 | As is | 250 mg |
| P-852522083 | 95 | As is | by synthesis |
| P-854841925 | 95 | As is | by synthesis |
| P-906815334 | 98 | As is | by synthesis |
| P-611590503 | 90 | As is | in stock |
| P-615645654 | 95 | As is | unavailable |
| P-1271680628 | 98 | As is | in stock |
| P-867547329 | 95 | Main component | in stock |
| P-875704218 | 95 | Main component | in stock |
| P-890838339 | 97 | Main component | in stock |
| P-590371759 | 95 | Main component | by resynthesis (? - ? days) |
| P-903029499 | 95 | Main component | 10 g |
| P-893516034 | 90 | Main component | 60.16 g |
| P-1270287773 | 95 | Main component | in stock |
| P-617057589 | 95 | Main component | by resynthesis (? - ? days) |
| P-606927316 | N/A | Main component | in stock |
| P-489150515 | 97 | Main component | in stock |
| P-596940144 | 95 | Main component | 15 g |
| P-494340258 | 95 | Main component | by resynthesis (? - ? days) |
| P-864085402 | 95 | Main component | in stock |
| P-889742997 | 95 | Main component | 3.75 g |
| P-580697800 | 95 | Main component | 1.6 g |
| P-851243689 | 95 | Main component | by synthesis |
| P-868648628 | 97 | Main component | in stock |
| P-580280513 | 95 | Main component | by resynthesis (? - ? days) |
| P-905332781 | 98 | Main component | 1000 mg |
| P-861962698 | 98 | Main component | 2.68 g |
| P-502529547 | 95 | Main component | by synthesis |
| P-619807125 | 96 | Main component | in stock |
| P-454287360 | 90 | Main component | 325 mg |
| P-613363011 | 95 | Main component | in stock |
| P-613314546 | 95 | Main component | by synthesis |
| P-1272595079 | 97 | Main component | 5 g |
| P-852502827 | 97 | Main component | by synthesis |
| P-868742259 | 95 | Main component | in stock |
| P-888883563 | N/A | Main component | in stock |
| P-500384611 | 98 | Main component | by synthesis |
| P-596791194 | 95 | Main component | 7.7 g |
| P-906793906 | 95 | Main component | by synthesis |
| P-611533725 | 90 | Main component | in stock |
| P-893943361 | 97 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 194.659 |
| logP | 2.33478 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 35.82 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 57.4637 |
| Atoms | 24 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 11 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
