MCULE-8315381896
- 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 | 18 USD | 99 | 19 working days | Get Quote |
| 5 mg | 18 USD | 99 | 19 working days | Get Quote |
| 10 mg | 18 USD | 99 | 19 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-8315381896.sdf |
| SMILES | MCULE-8315381896.smiles |
| Standard InChI | MCULE-8315381896.inchi |
| InChIKey | MCULE-8315381896.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867630664 | 97 | As is | in stock |
| P-875794674 | 99 | As is | in stock |
| P-1275157977 | 97 | As is | in stock |
| P-1275163372 | 99 | As is | in stock |
| P-903146192 | 98 | As is | 50 g |
| P-893505590 | 90 | As is | 9.3 g |
| P-1270341034 | 97 | As is | in stock |
| P-606872283 | N/A | As is | in stock |
| P-489236837 | 97 | As is | in stock |
| P-868839446 | 98 | As is | 50 g |
| P-895958296 | 95 | As is | 40 g |
| P-889589342 | 95 | As is | in stock |
| P-868954610 | 97 | As is | 27.7 g |
| P-448750541 | 90 | As is | 4.495 g |
| P-425395854 | 90 | As is | in stock |
| P-34888103 | 90 | As is | in stock |
| P-1272276599 | 95 | As is | by synthesis |
| P-861271255 | 95 | As is | in stock |
| P-868637800 | 97 | As is | in stock |
| P-905413327 | 98 | As is | 47 g |
| P-870657532 | N/A | As is | in stock |
| P-454391039 | 98 | As is | 73.385 g |
| P-18797941 | 98 | As is | 73.385 g |
| P-852413423 | 95 | As is | by synthesis |
| P-1272504578 | 95 | As is | in stock |
| P-492276761 | 95 | As is | 738 mg |
| P-12415474 | 90 | As is | 738 mg |
| P-889865479 | 95 | As is | by synthesis |
| P-19451091 | 90 | As is | in stock |
| P-502392911 | 90 | As is | in stock |
| P-22532677 | 90 | As is | 200 mg |
| P-906772065 | 98 | As is | by synthesis |
| P-611436763 | 90 | As is | in stock |
| P-893990357 | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 163.173 |
| logP | 1.4639 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 38.33 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 48.2267 |
| Atoms | 21 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 9 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |

