MCULE-4751903561
- 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 | 98 | 11 working days | Get Quote | 
| 5 mg | 13 USD | 98 | 11 working days | Get Quote | 
| 10 mg | 13 USD | 98 | 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.
 
- 
                    
                    
MCULE-8342683905
- Component type: Main
 
 - 
                    
                    
MCULE-6963397848
- Component type: Main
 
 
| Name | File | 
|---|---|
| SDF | MCULE-4751903561.sdf | 
| SMILES | MCULE-4751903561.smiles | 
| Standard InChI | MCULE-4751903561.inchi | 
| InChIKey | MCULE-4751903561.txt | 
| mcule product ID | Guaranteed purity (%) | Product matching | Availability | 
|---|---|---|---|
| P-892978977 | N/A | As is | by synthesis | 
| P-893110445 | N/A | As is | by synthesis | 
| P-893137093 | N/A | As is | by synthesis | 
| P-893135822 | N/A | As is | by synthesis | 
| P-893136081 | N/A | As is | by synthesis | 
| P-893138402 | N/A | As is | by synthesis | 
| P-505347740 | 98 | As is | in stock | 
| P-881671073 | 95 | As is | in stock | 
| P-606879251 | N/A | As is | in stock | 
| P-579787965 | 95 | As is | 655 g | 
| P-864186242 | 98 | As is | in stock | 
| P-580720550 | 95 | As is | 1.7 kg | 
| P-1263520030 | 95 | As is | by synthesis | 
| P-901521049 | 95 | As is | by synthesis | 
| P-901549682 | 95 | As is | by synthesis | 
| P-34868654 | 90 | As is | in stock | 
| P-868608605 | 98 | As is | in stock | 
| P-868661978 | 95 | As is | in stock | 
| P-580426638 | 95 | As is | by resynthesis (? - ? days) | 
| P-905340047 | 98 | As is | 1000 g | 
| P-862060972 | 98 | As is | 46.9592 kg | 
| P-608219957 | 98 | As is | in stock | 
| P-608220203 | 99 | As is | in stock | 
| P-500417017 | 98 | As is | in stock | 
| P-608219958 | 99 | As is | in stock | 
| P-870662287 | N/A | As is | in stock | 
| P-492217557 | 95 | As is | in stock | 
| P-873254710 | 97 | As is | 1.044 g | 
| P-596561989 | 97 | As is | 500 g | 
| P-596603224 | 95 | As is | 100 mg | 
| P-579613814 | 95 | As is | unavailable | 
| P-31275074 | 90 | As is | 10 g | 
| P-856039571 | 90 | As is | 10 g | 
| P-613284761 | 95 | As is | by synthesis | 
| P-580500042 | 98 | As is | by synthesis | 
| P-852504878 | N/A | As is | in stock | 
| P-904721287 | 90 | As is | in stock | 
| P-902970804 | 95 | As is | by synthesis | 
| P-904060081 | 95 | As is | by synthesis | 
| P-863734207 | 95 | As is | in stock | 
| P-584614430 | 95 | As is | in stock | 
| P-896071209 | 95 | As is | in stock | 
| P-608279954 | 98 | As is | in stock | 
| P-26584099 | 90 | As is | 25 g | 
| P-492286821 | 95 | As is | 25 g | 
| P-859995624 | 95 | As is | by synthesis | 
| P-18886323 | 90 | As is | in stock | 
| P-888433280 | 94 | As is | by resynthesis (? - ? days) | 
| P-906904760 | 99 | As is | in stock | 
| P-906770971 | 98 | As is | by synthesis | 
| P-906774840 | 99 | As is | by synthesis | 
| P-906770242 | 99 | As is | by synthesis | 
| P-906862436 | 98 | As is | by synthesis | 
| P-611420733 | 90 | As is | in stock | 
| P-3239026 | 90 | As is | 93 mg | 
| P-24917223 | 90 | As is | 93 mg | 
| P-575298698 | 95 | As is | in stock | 
| P-872820413 | 95 | As a main component | by synthesis | 
| P-1263101718 | N/A | As a main component | by synthesis | 
| P-905587905 | 95 | As a main component | by synthesis | 
| P-524191995 | 97 | As a main component | 5 g | 
| P-895849038 | 95 | As a main component | by synthesis | 
| P-889883296 | 95 | As a main component | by synthesis | 
| Property | Value | 
|---|---|
| Components | 1 | 
| Mass | 89.093 | 
| logP | 0.1185 | 
| H-bond acceptors | 3 | 
| H-bond donors | 2 | 
| Rotatable bonds | 1 | 
| PSA | 63.32 | 
| RO5 violations | 0 | 
| RO3 violations | 1 | 
| Refractivity | 21.0142 | 
| Atoms | 13 | 
| Rings | 0 | 
| Heavy atoms | 6 | 
| Hydrogen atoms | 7 | 
| Heteroatoms | 3 | 
| N/O atoms | 3 | 
| Inorganic atoms | 0 | 
| Halogen atoms | 0 | 
| Chiral centers | 1 | 
| R/S chiral centers | 0 | 
| Unknown chiral centers | 0 | 
| Undefined chiral centers | 1 | 
| Stereo double bonds | 0 | 
| Cis/trans stereo double bonds | 0 | 
| Unknown stereo double bonds | 0 | 
| Undefined stereo double bonds | 0 | 

