MCULE-2286698816
- 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 | 36 USD | 95 | 26 working days | Get Quote |
5 mg | 36 USD | 95 | 26 working days | Get Quote |
10 mg | 41 USD | 95 | 26 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-9253907881
- Component type: Main
Name | File |
---|---|
SDF | MCULE-2286698816.sdf |
SMILES | MCULE-2286698816.smiles |
Standard InChI | MCULE-2286698816.inchi |
InChIKey | MCULE-2286698816.txt |
mcule product ID | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|
P-674979664 | 95 | As is | by synthesis |
P-889929890 | N/A | As is | by synthesis |
P-615729641 | 95 | As is | in stock |
P-851693490 | N/A | As is | by synthesis |
P-864228946 | 95 | As is | by synthesis |
P-591103904 | 98 | As is | by synthesis |
P-454696621 | 90 | As is | in stock |
P-436448057 | 95 | As is | 40 g |
P-19940163 | 90 | As is | in stock |
P-861537164 | 95 | As is | by synthesis |
P-34572791 | 90 | As is | in stock |
P-889112016 | 95 | As is | 1000 mg |
P-454343588 | 90 | As is | unavailable |
P-852398246 | N/A | As is | in stock |
P-854905701 | 95 | As is | by synthesis |
P-19492397 | 90 | As is | in stock |
P-33467908 | 90 | As is | in stock |
P-502345292 | 90 | As is | in stock |
P-888479188 | 94 | As is | by resynthesis (? - ? days) |
P-611571598 | 90 | As is | in stock |
P-867619029 | 95 | As a main component | in stock |
P-867493747 | N/A | As a main component | by synthesis |
P-875781143 | N/A | As a main component | in stock |
P-904562326 | 95 | As a main component | in stock |
P-851833021 | N/A | As a main component | by synthesis |
P-864252835 | 95 | As a main component | by synthesis |
P-590983491 | 95 | As a main component | by synthesis |
P-901535281 | 95 | As a main component | by synthesis |
P-616226988 | 95 | As a main component | in stock |
P-4152350 | 90 | As a main component | 100 mg |
P-617652330 | 90 | As a main component | in stock |
P-619830944 | 90 | As a main component | 67 mg |
P-868565089 | 95 | As a main component | in stock |
P-34572801 | 90 | As a main component | in stock |
P-861298193 | 90 | As a main component | in stock |
P-580780504 | 90 | As a main component | by resynthesis (? - ? days) |
P-580769587 | 90 | As a main component | in stock |
P-855927407 | 95 | As a main component | 1000 mg |
P-855948005 | 95 | As a main component | 1000 mg |
P-580500263 | 95 | As a main component | by synthesis |
P-852608149 | N/A | As a main component | in stock |
P-895391758 | 95 | As a main component | by synthesis |
P-889875324 | 95 | As a main component | by synthesis |
P-888479192 | 94 | As a main component | by resynthesis (? - ? days) |
P-611442121 | 90 | As a main component | in stock |
P-893670855 | 95 | As a main component | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 163.259 |
logP | 3.4135 |
H-bond acceptors | 1 |
H-bond donors | 1 |
Rotatable bonds | 2 |
PSA | 26.02 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 53.6614 |
Atoms | 29 |
Rings | 1 |
Heavy atoms | 12 |
Hydrogen atoms | 17 |
Heteroatoms | 1 |
N/O atoms | 1 |
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 |