Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7235185881
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 | 98 | 14 working days | Get Quote |
| 5 mg | 7 USD | 98 | 14 working days | Get Quote |
| 10 mg | 7 USD | 98 | 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-7235185881.sdf |
| SMILES | MCULE-7235185881.smiles |
| Standard InChI | MCULE-7235185881.inchi |
| InChIKey | MCULE-7235185881.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867568940 | 98 | As is | in stock |
| P-875729450 | N/A | As is | in stock |
| P-590398863 | 95 | As is | in stock |
| P-903058367 | 98 | As is | 500 g |
| P-893513479 | 90 | As is | 834.75 g |
| P-606900921 | N/A | As is | in stock |
| P-489136493 | 97 | As is | in stock |
| P-619128995 | 98 | As is | 275 g |
| P-895925104 | 95 | As is | by resynthesis (? - ? days) |
| P-864086949 | 97 | As is | in stock |
| P-864087510 | 97 | As is | in stock |
| P-851293024 | 95 | As is | by synthesis |
| P-868554319 | 98 | As is | in stock |
| P-861963800 | 97 | As is | 345.849 g |
| P-500157505 | 96 | As is | in stock |
| P-563451274 | 97 | As is | 5 g |
| P-524183734 | 97 | As is | 25 g |
| P-563447735 | 97 | As is | 100 g |
| P-579628503 | 95 | As is | unavailable |
| P-14063108 | 95 | As is | 889 mg |
| P-601065407 | 90 | As is | 889 mg |
| P-852509050 | N/A | As is | in stock |
| P-863695058 | 95 | As is | in stock |
| P-885541820 | 95 | As is | by synthesis |
| P-611411880 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 229.316 |
| logP | 2.0963 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 49.77 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 67.3688 |
| Atoms | 39 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 23 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
