MCULE-5976054678
- 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
- Component type: Main
 
 
| Name | File | 
|---|---|
| SDF | MCULE-5976054678.sdf | 
| SMILES | MCULE-5976054678.smiles | 
| Standard InChI | MCULE-5976054678.inchi | 
| InChIKey | MCULE-5976054678.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-855983924 | 97 | As a main component | 1000 mg | 
| P-856008497 | 97 | As a main component | 100 mg | 
| P-856026933 | 90 | As a main component | 5 g | 
| P-856026825 | 90 | As a main component | 1000 mg | 
| 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-675095643 | 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 | 
| P-617764063 | 90 | As a main component | 53 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 | 

