Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6333176286
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 | 96 | 22 working days | Get Quote |
| 5 mg | 7 USD | 96 | 22 working days | Get Quote |
| 10 mg | 7 USD | 96 | 22 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.
| Name | File |
|---|---|
| SDF | MCULE-6333176286.sdf |
| SMILES | MCULE-6333176286.smiles |
| Standard InChI | MCULE-6333176286.inchi |
| InChIKey | MCULE-6333176286.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867564192 | 96 | As is | in stock |
| P-875723692 | 96 | As is | in stock |
| P-580454565 | 95 | As is | unavailable |
| P-1275158338 | 95 | As is | in stock |
| P-1275197380 | 98 | As is | in stock |
| P-903052869 | 95 | As is | 300 g |
| P-905482599 | 95 | As is | 10 g |
| P-893533851 | 90 | As is | 3.42828 kg |
| P-1270284942 | 95 | As is | in stock |
| P-617066012 | 95 | As is | in stock |
| P-606935262 | N/A | As is | in stock |
| P-489164072 | 97 | As is | in stock |
| P-596946350 | 95 | As is | 1000 g |
| P-895958281 | 95 | As is | 3.1 g |
| P-864176670 | 95 | As is | in stock |
| P-580725482 | 95 | As is | 251 g |
| P-901462519 | 95 | As is | by synthesis |
| P-868618497 | 95 | As is | in stock |
| P-580291168 | N/A | As is | by resynthesis (? - ? days) |
| P-905344419 | 95 | As is | 38 g |
| P-862023973 | 95 | As is | 1.31153 kg |
| P-675214368 | 95 | As is | in stock |
| P-854062704 | 90 | As is | in stock |
| P-596571264 | 95 | As is | 5 g |
| P-870640325 | 95 | As is | 100 mg |
| P-579623925 | 95 | As is | in stock |
| P-31177448 | 90 | As is | 500 mg |
| P-904073271 | 95 | As is | in stock |
| P-885546198 | 95 | As is | by synthesis |
| P-596789154 | 95 | As is | 489.7 g |
| P-611381410 | 90 | As is | in stock |
| P-611517689 | 90 | As is | in stock |
| P-615434022 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 175.144 |
| logP | 1.135 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 62.1 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 54.156 |
| Atoms | 18 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 5 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
