MCULE-7076963744
- 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 | 13 USD | 95 | 11 working days | Get Quote | 
| 5 mg | 13 USD | 95 | 11 working days | Get Quote | 
| 10 mg | 13 USD | 95 | 11 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-7076963744.sdf | 
| SMILES | MCULE-7076963744.smiles | 
| Standard InChI | MCULE-7076963744.inchi | 
| InChIKey | MCULE-7076963744.txt | 
| mcule product ID | Guaranteed purity (%) | Product matching | Availability | 
|---|---|---|---|
| P-867589549 | 98 | As is | in stock | 
| P-875749150 | N/A | As is | in stock | 
| P-535625084 | 95 | As is | in stock | 
| P-505389301 | 99 | As is | in stock | 
| P-489164128 | 97 | As is | in stock | 
| P-866729798 | 95 | As is | unavailable | 
| P-864186261 | 98 | As is | in stock | 
| P-889740094 | 95 | As is | 25 g | 
| P-1263541860 | 95 | As is | by synthesis | 
| P-3319277 | 90 | As is | 15 mg | 
| P-868609998 | 95 | As is | in stock | 
| P-889110141 | 98 | As is | 1.5005 kg | 
| P-905328294 | 98 | As is | 475 g | 
| P-608220936 | 98 | As is | in stock | 
| P-505492886 | 95 | As is | in stock | 
| P-504609422 | 90 | As is | by synthesis | 
| P-890849259 | 95 | As is | in stock | 
| P-488550977 | 90 | As is | in stock | 
| P-855992654 | 98 | As is | 100 mg | 
| P-524164586 | 98 | As is | 100 g | 
| P-579616988 | 99 | As is | 520 g | 
| P-856041500 | 90 | As is | 10 g | 
| P-31251336 | 90 | As is | 10 g | 
| P-580514689 | 98 | As is | 550 g | 
| P-852426825 | N/A | As is | in stock | 
| P-899991994 | 95 | As is | by synthesis | 
| P-895183763 | 95 | As is | in stock | 
| P-621084003 | 90 | As is | by synthesis | 
| P-26576200 | 90 | As is | 1000 mg | 
| P-620238074 | 95 | As is | 1000 mg | 
| P-454369219 | 92 | As is | in stock | 
| P-500409679 | 97 | As is | by synthesis | 
| P-889862385 | 95 | As is | by synthesis | 
| P-18853434 | 90 | As is | in stock | 
| P-892274645 | 95 | As is | by synthesis | 
| P-892299455 | 95 | As is | 1.019 g | 
| P-892351051 | 95 | As is | 1.019 g | 
| P-33508938 | 90 | As is | in stock | 
| P-502366877 | 90 | As is | in stock | 
| Property | Value | 
|---|---|
| Components | 1 | 
| Mass | 245.868 | 
| logP | 2.5166 | 
| H-bond acceptors | 2 | 
| H-bond donors | 0 | 
| Rotatable bonds | 0 | 
| PSA | 34.14 | 
| RO5 violations | 0 | 
| RO3 violations | 0 | 
| Refractivity | 47.478 | 
| Atoms | 12 | 
| Rings | 1 | 
| Heavy atoms | 12 | 
| Hydrogen atoms | 0 | 
| Heteroatoms | 6 | 
| N/O atoms | 2 | 
| Inorganic atoms | 0 | 
| Halogen atoms | 4 | 
| 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 | 

