MCULE-4205860758-0
- 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 | 8 working days | Get Quote |
| 5 mg | 10 USD | 98 | 8 working days | Get Quote |
| 10 mg | 10 USD | 98 | 8 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-4205860758-0.sdf |
| SMILES | MCULE-4205860758-0.smiles |
| Standard InChI | MCULE-4205860758-0.inchi |
| InChIKey | MCULE-4205860758-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867586765 | 98 | As is | in stock |
| P-875745354 | N/A | As is | in stock |
| P-597018068 | 95 | As is | in stock |
| P-590367847 | 98 | As is | in stock |
| P-903076273 | 98 | As is | 400 g |
| P-893576383 | 90 | As is | 632.38 g |
| P-606942576 | N/A | As is | in stock |
| P-489136245 | 97 | As is | in stock |
| P-596984215 | 98 | As is | 200 g |
| P-895957001 | 95 | As is | 51.1 g |
| P-864088518 | 97 | As is | in stock |
| P-616205742 | 98 | As is | 58 g |
| P-290723 | 90 | As is | 10 mg |
| P-861305431 | 95 | As is | 10 g |
| P-868642183 | 98 | As is | in stock |
| P-580271332 | 95 | As is | by resynthesis (? - ? days) |
| P-862035416 | 97 | As is | 41.67 g |
| P-905347451 | 97 | As is | 7 g |
| P-502452744 | 95 | As is | by synthesis |
| P-12542228 | 95 | As is | 166 mg |
| P-454313182 | 90 | As is | 213 mg |
| P-454399418 | 90 | As is | 50 g |
| P-579680733 | 95 | As is | by resynthesis (? - ? days) |
| P-31197693 | 90 | As is | unavailable |
| P-588862284 | 90 | As is | 50 mg |
| P-852425653 | N/A | As is | in stock |
| P-35166055 | 90 | As is | 13.85 kg |
| P-863734586 | 95 | As is | in stock |
| P-608279279 | 98 | As is | in stock |
| P-500392779 | 98 | As is | by synthesis |
| P-885535720 | 95 | As is | by synthesis |
| P-424840187 | 90 | As is | in stock |
| P-617404855 | N/A | As is | in stock |
| P-12651423 | 90 | As is | 1.04 g |
| P-580052686 | 95 | As is | by synthesis |
| P-869178811 | 95 | As is | in stock |
| P-892300912 | 95 | As is | unavailable |
| P-892352845 | 95 | As is | 100 mg |
| P-22442933 | 90 | As is | 20 mg |
| P-611604317 | 90 | As is | in stock |
| P-1829734 | 90 | As is | 584 mg |
| P-615406644 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 218.205 |
| logP | 1.9697 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 56.51 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 58.5705 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 10 |
| 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 |

