Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7851608394
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 | 13 USD | 98 | 9 working days | Get Quote |
| 5 mg | 13 USD | 98 | 9 working days | Get Quote |
| 10 mg | 13 USD | 98 | 9 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.
-
MCULE-8502180773
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7851608394.sdf |
| SMILES | MCULE-7851608394.smiles |
| Standard InChI | MCULE-7851608394.inchi |
| InChIKey | MCULE-7851608394.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867579731 | 98 | As is | in stock |
| P-875738741 | 98 | As is | in stock |
| P-1275199263 | 98 | As is | in stock |
| P-1275148094 | 95 | As is | in stock |
| P-903069311 | 97 | As is | 2.1 kg |
| P-905480301 | 98 | As is | 100 g |
| P-893464939 | 90 | As is | 1.5038 kg |
| P-580253926 | 95 | As is | by synthesis |
| P-617061580 | 95 | As is | in stock |
| P-489195137 | 97 | As is | in stock |
| P-596952158 | 97 | As is | 200 g |
| P-864087828 | 97 | As is | in stock |
| P-851246410 | 95 | As is | by synthesis |
| P-868648377 | 98 | As is | in stock |
| P-580443244 | 95 | As is | by resynthesis (? - ? days) |
| P-505523188 | 95 | As is | in stock |
| P-502546803 | 95 | As is | by synthesis |
| P-500153441 | 96 | As is | in stock |
| P-579623201 | 95 | As is | in stock |
| P-613276516 | 95 | As is | by synthesis |
| P-580481625 | N/A | As is | by synthesis |
| P-852378811 | 99 | As is | by synthesis |
| P-885548045 | 95 | As is | by synthesis |
| P-613814307 | 95 | As is | in stock |
| P-498672778 | 97 | As is | 97.5 g |
| P-906759142 | 98 | As is | by synthesis |
| P-580448962 | 97 | As is | in stock |
| P-893983480 | 98 | As is | in stock |
| P-1266134237 | 96 | As a main component | in stock |
| P-901278135 | 96 | As a main component | in stock |
| P-869355570 | 98 | As a main component | by resynthesis (? - ? days) |
| P-901516263 | 95 | As a main component | by synthesis |
| P-851292410 | 95 | As a main component | by synthesis |
| P-868574157 | 96 | As a main component | in stock |
| P-500153442 | 96 | As a main component | in stock |
| P-611372231 | 90 | As a main component | in stock |
| P-615461745 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 155.623 |
| logP | 2.5415 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 26.02 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 43.9324 |
| Atoms | 20 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 10 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| 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 |
