MCULE-2408708268
- 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 | 28 USD | 98 | 16 working days | Get Quote |
| 5 mg | 28 USD | 98 | 16 working days | Get Quote |
| 10 mg | 38 USD | 95 | 18 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-2408708268.sdf |
| SMILES | MCULE-2408708268.smiles |
| Standard InChI | MCULE-2408708268.inchi |
| InChIKey | MCULE-2408708268.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867607477 | 99 | As is | in stock |
| P-875766056 | N/A | As is | in stock |
| P-869187014 | 95 | As is | in stock |
| P-869289903 | 99 | As is | in stock |
| P-505399248 | 98 | As is | in stock |
| P-1264048807 | 95 | As is | in stock |
| P-610954244 | 90 | As is | 52.573 g |
| P-489189076 | 97 | As is | in stock |
| P-865913666 | 97 | As is | unavailable |
| P-580193204 | 98 | As is | in stock |
| P-864143682 | 95 | As is | in stock |
| P-860056185 | 98 | As is | by synthesis |
| P-901413279 | 95 | As is | in stock |
| P-893233387 | 95 | As is | in stock |
| P-577095474 | 97 | As is | in stock |
| P-860798390 | 98 | As is | in stock |
| P-580452407 | 98 | As is | in stock |
| P-868623176 | 98 | As is | in stock |
| P-579478723 | 95 | As is | in stock |
| P-505535098 | 95 | As is | in stock |
| P-524439102 | 97 | As is | 1.365 g |
| P-852459669 | N/A | As is | in stock |
| P-863723910 | 95 | As is | in stock |
| P-1263159368 | 95 | As is | in stock |
| P-474023195 | 95 | As is | in stock |
| P-608274835 | 98 | As is | in stock |
| P-579716312 | N/A | As is | in stock |
| P-491405653 | 95 | As is | by synthesis |
| P-505618044 | 97 | As is | in stock |
| P-617403079 | N/A | As is | in stock |
| P-869161926 | 95 | As is | by synthesis |
| P-892296843 | 95 | As is | unavailable |
| P-888657316 | 95 | As is | 180 mg |
| P-588815065 | N/A | As is | by synthesis |
| P-886927880 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 453.501 |
| logP | 6.2014 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 8 |
| PSA | 112.96 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 111.7628 |
| Atoms | 48 |
| Rings | 3 |
| Heavy atoms | 30 |
| Hydrogen atoms | 18 |
| Heteroatoms | 9 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |

