Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8365494376
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 | 22 working days | Get Quote |
| 5 mg | 32 USD | 98 | 22 working days | Get Quote |
| 10 mg | 46 USD | 98 | 22 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-8365494376.sdf |
| SMILES | MCULE-8365494376.smiles |
| Standard InChI | MCULE-8365494376.inchi |
| InChIKey | MCULE-8365494376.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867570316 | 98 | As is | in stock |
| P-875730502 | N/A | As is | in stock |
| P-505394139 | 95 | As is | in stock |
| P-853438153 | 95 | As is | in stock |
| P-903059938 | 98 | As is | 100 mg |
| P-610959373 | 90 | As is | 16.184 g |
| P-606854543 | N/A | As is | in stock |
| P-489202266 | 97 | As is | in stock |
| P-596949251 | 98 | As is | 500 mg |
| P-580192776 | 98 | As is | in stock |
| P-864228780 | 95 | As is | by synthesis |
| P-868544498 | 99 | As is | in stock |
| P-890229420 | 98 | As is | by synthesis |
| P-871218931 | N/A | As is | by resynthesis (? - ? days) |
| P-851251948 | 95 | As is | by synthesis |
| P-860798997 | 98 | As is | in stock |
| P-861512664 | 95 | As is | by synthesis |
| P-579479282 | 95 | As is | in stock |
| P-868078771 | 95 | As is | in stock |
| P-852524227 | N/A | As is | in stock |
| P-854714427 | 95 | As is | in stock |
| P-474022244 | 95 | As is | in stock |
| P-608277709 | 98 | As is | in stock |
| P-579712149 | N/A | As is | in stock |
| P-869131784 | 95 | As is | by synthesis |
| P-892292009 | 95 | As is | unavailable |
| P-888642797 | 95 | As is | 194 mg |
| P-868492796 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 579.687 |
| logP | 5.6054 |
| H-bond acceptors | 9 |
| H-bond donors | 2 |
| Rotatable bonds | 9 |
| PSA | 105.56 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 173.5864 |
| Atoms | 80 |
| Rings | 5 |
| Heavy atoms | 43 |
| Hydrogen atoms | 37 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| 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 |
