Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9178311509
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 | 10 USD | 98 | 20 working days | Get Quote |
| 5 mg | 10 USD | 98 | 20 working days | Get Quote |
| 10 mg | 10 USD | 98 | 20 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-9178311509.sdf |
| SMILES | MCULE-9178311509.smiles |
| Standard InChI | MCULE-9178311509.inchi |
| InChIKey | MCULE-9178311509.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867589667 | 90 | As is | in stock |
| P-875749595 | N/A | As is | in stock |
| P-590402357 | 95 | As is | in stock |
| P-903080500 | 97 | As is | 400 g |
| P-893503186 | 90 | As is | 1.20802 kg |
| P-606944129 | N/A | As is | in stock |
| P-489107629 | 97 | As is | in stock |
| P-596984598 | 98 | As is | 400 g |
| P-494348346 | 95 | As is | 3.6 g |
| P-864185389 | 95 | As is | in stock |
| P-606956141 | 97 | As is | 6 g |
| P-868642602 | 98 | As is | in stock |
| P-580406652 | 95 | As is | by resynthesis (? - ? days) |
| P-861941313 | 95 | As is | 68.66 g |
| P-901378374 | 95 | As is | 41.95 g |
| P-905330887 | 95 | As is | 41 g |
| P-890211726 | 90 | As is | in stock |
| P-579522911 | 90 | As is | 1 mg |
| P-505491359 | 95 | As is | in stock |
| P-454349126 | 95 | As is | 193 mg |
| P-454415979 | 95 | As is | 10 g |
| P-579626607 | 95 | As is | 10 g |
| P-856013361 | 90 | As is | 500 mg |
| P-852384496 | N/A | As is | in stock |
| P-855397738 | 95 | As is | in stock |
| P-500395940 | 98 | As is | by synthesis |
| P-859989008 | 95 | As is | by synthesis |
| P-505617522 | 95 | As is | in stock |
| P-896081194 | N/A | As is | 981 mg |
| P-502393140 | 90 | As is | in stock |
| P-906904691 | 96 | As is | in stock |
| P-611365277 | 90 | As is | in stock |
| P-893937947 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 165.146 |
| logP | 1.184 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 80.39 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 41.4962 |
| Atoms | 19 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 7 |
| 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 |
