MCULE-9272182467-0
- 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 | 61 USD | 95 | 14 working days | Get Quote | 
| 5 mg | 61 USD | 95 | 14 working days | Get Quote | 
| 10 mg | 61 USD | 95 | 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-8203929750-0
- Component type: Main
 
 
| Name | File | 
|---|---|
| SDF | MCULE-9272182467-0.sdf | 
| SMILES | MCULE-9272182467-0.smiles | 
| Standard InChI | MCULE-9272182467-0.inchi | 
| InChIKey | MCULE-9272182467-0.txt | 
| mcule product ID | Guaranteed purity (%) | Product matching | Availability | 
|---|---|---|---|
| P-886610505 | 95 | As is | in stock | 
| P-901271409 | N/A | As is | in stock | 
| P-869329735 | 95 | As is | in stock | 
| P-903148077 | 95 | As is | 5 g | 
| P-893616462 | 90 | As is | 1.297 g | 
| P-580259085 | 95 | As is | by synthesis | 
| P-888929377 | N/A | As is | by synthesis | 
| P-905463933 | 95 | As is | in stock | 
| P-901875766 | 95 | As is | by synthesis | 
| P-901435477 | 95 | As is | by synthesis | 
| P-505608865 | 95 | As is | by synthesis | 
| P-851257719 | 95 | As is | by synthesis | 
| P-889037129 | 95 | As is | by synthesis | 
| P-580276430 | 95 | As is | by resynthesis (? - ? days) | 
| P-905435271 | N/A | As is | 246 mg | 
| P-675514766 | 95 | As is | in stock | 
| P-14439720 | 90 | As is | 5 mg | 
| P-852504419 | N/A | As is | in stock | 
| P-895224138 | 95 | As is | in stock | 
| P-906888011 | 98 | As is | by synthesis | 
| P-855323196 | 90 | As is | in stock | 
| P-893833991 | 95 | As is | by synthesis | 
| P-893559693 | 90 | As a main component | 29.4 g | 
| Property | Value | 
|---|---|
| Components | 1 | 
| Mass | 152.194 | 
| logP | 1.9733 | 
| H-bond acceptors | 3 | 
| H-bond donors | 2 | 
| Rotatable bonds | 2 | 
| PSA | 47.28 | 
| RO5 violations | 0 | 
| RO3 violations | 0 | 
| Refractivity | 46.6441 | 
| Atoms | 23 | 
| Rings | 1 | 
| Heavy atoms | 11 | 
| Hydrogen atoms | 12 | 
| 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 | 

