MCULE-5976054678-0
- 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 | 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 |
- 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.
-
MCULE-8792081568-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5976054678-0.sdf |
| SMILES | MCULE-5976054678-0.smiles |
| Standard InChI | MCULE-5976054678-0.inchi |
| InChIKey | MCULE-5976054678-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867660796 | 99 | As is | in stock |
| P-875829599 | N/A | As is | in stock |
| P-869189799 | 95 | As is | in stock |
| P-505388994 | 99 | As is | in stock |
| P-505390923 | 98 | As is | in stock |
| P-903204660 | 95 | As is | 95 g |
| P-905493783 | 95 | As is | 1000 mg |
| P-596985805 | 95 | As is | 10 g |
| P-872728034 | 98 | As is | in stock |
| P-905466480 | 95 | As is | in stock |
| P-893225712 | 95 | As is | in stock |
| P-851265379 | 95 | As is | by synthesis |
| P-868595869 | 98 | As is | in stock |
| P-524443321 | 97 | As is | 4.045 g |
| P-852467892 | N/A | As is | in stock |
| P-899992456 | 95 | As is | in stock |
| P-904369107 | 95 | As is | in stock |
| P-617403228 | N/A | As is | in stock |
| P-611470286 | 90 | As is | in stock |
| P-615413011 | 95 | As is | in stock |
| P-867599654 | 98 | As a main component | in stock |
| P-875757847 | N/A | As a main component | in stock |
| P-597027890 | 97 | As a main component | in stock |
| P-590379848 | 98 | As a main component | in stock |
| P-869280886 | 99 | As a main component | in stock |
| P-903092566 | 98 | As a main component | 1.5 kg |
| P-580194312 | 98 | As a main component | in stock |
| P-864196829 | 95 | As a main component | in stock |
| P-900267659 | N/A | As a main component | by resynthesis (? - ? days) |
| P-901443434 | 95 | As a main component | by synthesis |
| P-617651413 | 90 | As a main component | in stock |
| P-619369128 | 90 | As a main component | 142 mg |
| P-584603014 | 95 | As a main component | 1000 mg |
| P-851268301 | 95 | As a main component | by synthesis |
| P-887966436 | 98 | As a main component | in stock |
| P-608494915 | 95 | As a main component | in stock |
| P-870652293 | 98 | As a main component | in stock |
| P-505491686 | 95 | As a main component | in stock |
| P-488549367 | 90 | As a main component | in stock |
| P-24171906 | 95 | As a main component | 300 mg |
| P-856008497 | 97 | As a main component | 100 mg |
| P-855983924 | 97 | As a main component | 1000 mg |
| P-856026933 | 90 | As a main component | 5 g |
| P-580460144 | 95 | As a main component | by synthesis |
| P-852426687 | N/A | As a main component | in stock |
| P-902989409 | 95 | As a main component | by synthesis |
| P-899992580 | 95 | As a main component | in stock |
| P-474022299 | 95 | As a main component | in stock |
| P-608276650 | 98 | As a main component | in stock |
| P-881189303 | 90 | As a main component | 50 mg |
| P-454371622 | 92 | As a main component | in stock |
| P-885534952 | 95 | As a main component | by synthesis |
| P-889853029 | 95 | As a main component | by synthesis |
| P-675080830 | 90 | As a main component | in stock |
| P-579710962 | N/A | As a main component | in stock |
| P-502365884 | 90 | As a main component | in stock |
| P-611470289 | 90 | As a main component | in stock |
| P-617739204 | 90 | As a main component | 208 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 318.864 |
| logP | 4.9594 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 31.78 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 95.079 |
| Atoms | 40 |
| Rings | 3 |
| Heavy atoms | 21 |
| Hydrogen atoms | 19 |
| Heteroatoms | 4 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |

