Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6988978811
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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 29 USD | 92 | 18 working days | Get Quote |
| 10 mg | 65 USD | 95 | 11 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-6988978811.sdf |
| SMILES | MCULE-6988978811.smiles |
| Standard InChI | MCULE-6988978811.inchi |
| InChIKey | MCULE-6988978811.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-892979636 | N/A | As is | by synthesis |
| P-867603996 | 95 | As is | in stock |
| P-875761450 | N/A | As is | in stock |
| P-613846636 | 95 | As is | in stock |
| P-903097801 | 95 | As is | 200 mg |
| P-904320576 | 90 | As is | 400 mg |
| P-851571242 | N/A | As is | by synthesis |
| P-851770664 | N/A | As is | by synthesis |
| P-895095682 | N/A | As is | 200 mg |
| P-872727798 | 98 | As is | in stock |
| P-590813794 | 95 | As is | by synthesis |
| P-590959981 | 95 | As is | by synthesis |
| P-492268555 | 95 | As is | in stock |
| P-427955516 | 90 | As is | 10 mg |
| P-868569020 | 95 | As is | in stock |
| P-580405935 | 95 | As is | by resynthesis (? - ? days) |
| P-502445757 | 95 | As is | by synthesis |
| P-502468555 | 95 | As is | by synthesis |
| P-502766628 | 90 | As is | in stock |
| P-502771152 | 90 | As is | in stock |
| P-492222115 | 95 | As is | in stock |
| P-12729057 | 95 | As is | 9 mg |
| P-855947244 | 95 | As is | 1000 mg |
| P-895191369 | 95 | As is | by synthesis |
| P-26349064 | 90 | As is | 3 mg |
| P-12960934 | 90 | As is | 310 mg |
| P-492285890 | 95 | As is | 310 mg |
| P-13978424 | 92 | As is | 9 mg |
| P-579243355 | 90 | As is | in stock |
| P-896076426 | N/A | As is | 20 mg |
| P-896078437 | N/A | As is | 8.883 g |
| P-502385971 | 90 | As is | in stock |
| P-22515819 | 90 | As is | 220 mg |
| P-24787313 | 90 | As is | 9 mg |
| P-893672047 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 239.225 |
| logP | 2.7918 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 70.42 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 68.2313 |
| Atoms | 27 |
| Rings | 3 |
| Heavy atoms | 18 |
| Hydrogen atoms | 9 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
