Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8138595213
Compound
Show structures
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 | 13 USD | 98 | 14 working days | Get Quote |
| 5 mg | 13 USD | 98 | 14 working days | Get Quote |
| 10 mg | 13 USD | 98 | 14 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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.
-
MCULE-9558876393
- Component type: Main
-
MCULE-6645528455
- Component type: Main
-
MCULE-2531979414
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8138595213.sdf |
| SMILES | MCULE-8138595213.smiles |
| Standard InChI | MCULE-8138595213.inchi |
| InChIKey | MCULE-8138595213.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867566295 | 98 | As is | in stock |
| P-875726093 | N/A | As is | in stock |
| P-597026705 | 95 | As is | in stock |
| P-580240746 | 95 | As is | by synthesis |
| P-489113539 | 97 | As is | in stock |
| P-895957993 | 95 | As is | unavailable |
| P-864107436 | 95 | As is | in stock |
| P-868579073 | 98 | As is | in stock |
| P-580304800 | 95 | As is | by resynthesis (? - ? days) |
| P-889115524 | 96 | As is | 1.8 g |
| P-505492884 | 95 | As is | in stock |
| P-500152807 | 96 | As is | in stock |
| P-855997819 | 95 | As is | 100 mg |
| P-454412865 | 95 | As is | 25 g |
| P-580496123 | 97 | As is | by synthesis |
| P-852525269 | N/A | As is | in stock |
| P-500389604 | 98 | As is | by synthesis |
| P-885540134 | 95 | As is | by synthesis |
| P-873224771 | 90 | As is | in stock |
| P-867661695 | 98 | As a main component | in stock |
| P-875735830 | N/A | As a main component | in stock |
| P-875830681 | N/A | As a main component | in stock |
| P-881662073 | 95 | As a main component | in stock |
| P-590372548 | 98 | As a main component | in stock |
| P-505353408 | 98 | As a main component | in stock |
| P-903205812 | 98 | As a main component | 600 g |
| P-596990192 | 98 | As a main component | 600 g |
| P-1263771246 | 95 | As a main component | by synthesis |
| P-904972238 | 95 | As a main component | by synthesis |
| P-861469695 | 95 | As a main component | by synthesis |
| P-868613482 | 98 | As a main component | in stock |
| P-870657459 | 98 | As a main component | in stock |
| P-505493403 | 95 | As a main component | in stock |
| P-454403529 | 97 | As a main component | 25 g |
| P-855955197 | 97 | As a main component | 25 g |
| P-579616472 | 97 | As a main component | 50 g |
| P-31250879 | 90 | As a main component | unavailable |
| P-856041966 | 90 | As a main component | unavailable |
| P-852460495 | N/A | As a main component | in stock |
| P-864074285 | 95 | As a main component | by synthesis |
| P-885540133 | 95 | As a main component | by synthesis |
| P-33255517 | 90 | As a main component | in stock |
| P-611432667 | 90 | As a main component | in stock |
| P-615411973 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 122.168 |
| logP | 2.3218 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 0 |
| PSA | 52.04 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 40.2168 |
| Atoms | 19 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 10 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
