MCULE-9747714953
- 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 | 28 USD | 92 | 18 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.
-
1
MCULE-9668986440
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
Name | File |
---|---|
SDF | MCULE-9747714953.sdf |
SMILES | MCULE-9747714953.smiles |
Standard InChI | MCULE-9747714953.inchi |
InChIKey | MCULE-9747714953.txt |
mcule product ID | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|
P-597024504 | 95 | As is | in stock |
P-505391756 | 95 | As is | in stock |
P-610973183 | 90 | As is | 24.5 g |
P-580238891 | 95 | As is | by synthesis |
P-489186971 | 97 | As is | in stock |
P-864086573 | 95 | As is | in stock |
P-893230202 | 95 | As is | in stock |
P-4173481 | 90 | As is | 1 mg |
P-619933447 | 90 | As is | by synthesis |
P-617653751 | 90 | As is | by synthesis |
P-617652342 | 90 | As is | in stock |
P-619307033 | 90 | As is | 58 mg |
P-584595899 | 95 | As is | 35 g |
P-517165386 | 90 | As is | in stock |
P-851243826 | 95 | As is | by synthesis |
P-861274860 | 95 | As is | in stock |
P-868643894 | 95 | As is | in stock |
P-34578771 | 90 | As is | in stock |
P-861298488 | 90 | As is | in stock |
P-580780590 | 90 | As is | by resynthesis (? - ? days) |
P-580769664 | 90 | As is | in stock |
P-580407512 | 95 | As is | by resynthesis (? - ? days) |
P-594269518 | 90 | As is | in stock |
P-579803337 | 90 | As is | in stock |
P-580089319 | 95 | As is | 48.97 g |
P-580045059 | 90 | As is | in stock |
P-580006479 | 95 | As is | in stock |
P-488543822 | 90 | As is | in stock |
P-24482478 | 95 | As is | 300 mg |
P-588251713 | N/A | As is | by synthesis |
P-852405688 | N/A | As is | in stock |
P-593630068 | 95 | As is | by synthesis |
P-424201300 | 90 | As is | 92 mg |
P-620226965 | 95 | As is | 48.97 g |
P-454363924 | 92 | As is | in stock |
P-13797958 | 92 | As is | 300 mg |
P-674672800 | 92 | As is | 300 mg |
P-500399619 | 98 | As is | by synthesis |
P-885560066 | 95 | As is | by synthesis |
P-675093613 | 90 | As is | in stock |
P-34173859 | 90 | As is | in stock |
P-502401112 | 90 | As is | in stock |
P-873213031 | 90 | As is | in stock |
P-888602049 | 94 | As is | by resynthesis (? - ? days) |
P-906862795 | 95 | As is | by synthesis |
P-906887897 | 98 | As is | by synthesis |
P-855034893 | 90 | As is | in stock |
P-855072963 | 90 | As is | in stock |
P-617741820 | 90 | As is | 477 mg |
P-575293552 | 95 | As is | in stock |
P-892870772 | 95 | Main component | in stock |
P-901283773 | N/A | Main component | in stock |
P-580232812 | 95 | Main component | by synthesis |
P-489139669 | 97 | Main component | in stock |
P-864211891 | 97 | Main component | by synthesis |
P-901457883 | 95 | Main component | by synthesis |
P-851275608 | 95 | Main component | by synthesis |
P-861275944 | 95 | Main component | in stock |
P-868580356 | 95 | Main component | in stock |
P-580281293 | 95 | Main component | by resynthesis (? - ? days) |
P-579523267 | 90 | Main component | 1 mg |
P-890212075 | 90 | Main component | in stock |
P-505524471 | 95 | Main component | in stock |
P-580463716 | N/A | Main component | by synthesis |
P-500393404 | 98 | Main component | by synthesis |
P-611385904 | 90 | Main component | in stock |
P-886968663 | 95 | Main component | by synthesis |
Property | Value |
---|---|
Components | 2 |
Mass | 214.665 |
logP | 3.3105 |
H-bond acceptors | 2 |
H-bond donors | 2 |
Rotatable bonds | 2 |
PSA | 41.81 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 57.7021 |
Atoms | 26 |
Rings | 2 |
Heavy atoms | 14 |
Hydrogen atoms | 12 |
Heteroatoms | 4 |
N/O atoms | 2 |
Inorganic atoms | 0 |
Halogen atoms | 2 |
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 |