Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9978317250
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 | 7 USD | 99 | 14 working days | Get Quote |
| 5 mg | 7 USD | 99 | 14 working days | Get Quote |
| 10 mg | 7 USD | 99 | 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.
| Name | File |
|---|---|
| SDF | MCULE-9978317250.sdf |
| SMILES | MCULE-9978317250.smiles |
| Standard InChI | MCULE-9978317250.inchi |
| InChIKey | MCULE-9978317250.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867565808 | 98 | As is | in stock |
| P-875725083 | N/A | As is | in stock |
| P-869188556 | 95 | As is | in stock |
| P-617433420 | 98 | As is | in stock |
| P-903054637 | 99 | As is | 2.5 kg |
| P-580199505 | 95 | As is | 2 g |
| P-868821558 | N/A | As is | in stock |
| P-489112353 | 97 | As is | in stock |
| P-596975431 | 98 | As is | 25 kg |
| P-889578687 | 95 | As is | in stock |
| P-892504994 | 95 | As is | 400 g |
| P-868611455 | 98 | As is | in stock |
| P-896534785 | 98 | As is | 442.5 g |
| P-488550766 | 90 | As is | in stock |
| P-596602476 | 95 | As is | 25 g |
| P-31250580 | 90 | As is | unavailable |
| P-856042173 | 90 | As is | unavailable |
| P-613281855 | 95 | As is | by synthesis |
| P-852510794 | N/A | As is | in stock |
| P-619972899 | 90 | As is | 1000 mg |
| P-620215734 | 95 | As is | 1000 mg |
| P-500406585 | 98 | As is | by synthesis |
| P-885528439 | 95 | As is | by synthesis |
| P-579267517 | 90 | As is | in stock |
| P-502366824 | 90 | As is | in stock |
| P-464681202 | 90 | As is | unavailable |
| P-590432404 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 154.592 |
| logP | 2.374 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 17.07 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 41.5915 |
| Atoms | 17 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 7 |
| 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 |
