MCULE-4792993119
- 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 | 7 USD | 99 | 14 working days | Get Quote |
5 mg | 7 USD | 99 | 14 working days | Get Quote |
10 mg | 7 USD | 99 | 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-4892334961
- Component type: Main
-
MCULE-7419869596
- Component type: Main
-
MCULE-6432698897
- Component type: Main
Name | File |
---|---|
SDF | MCULE-4792993119.sdf |
SMILES | MCULE-4792993119.smiles |
Standard InChI | MCULE-4792993119.inchi |
InChIKey | MCULE-4792993119.txt |
mcule product ID | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|
P-886638280 | 95 | As is | in stock |
P-890163458 | N/A | As is | in stock |
P-853440064 | 95 | As is | in stock |
P-903184206 | 98 | As is | 400 mg |
P-851415876 | N/A | As is | by synthesis |
P-873296884 | 98 | As is | 300 mg |
P-905466816 | 95 | As is | in stock |
P-611122849 | 95 | As is | by synthesis |
P-675063077 | 90 | As is | in stock |
P-505493142 | 95 | As is | in stock |
P-899784464 | 97 | As is | 50 mg |
P-524183597 | 98 | As is | 5 g |
P-881193907 | 90 | As is | 50 mg |
P-491319087 | 95 | As is | by synthesis |
P-888602955 | 94 | As is | by resynthesis (? - ? days) |
P-906890902 | 98 | As is | by synthesis |
P-893159782 | N/A | As a main component | by synthesis |
P-867585765 | 98 | As a main component | in stock |
P-867619723 | 98 | As a main component | in stock |
P-875744482 | N/A | As a main component | in stock |
P-875781485 | N/A | As a main component | in stock |
P-869356252 | 95 | As a main component | in stock |
P-903074894 | 99 | As a main component | 200 g |
P-903128054 | 99 | As a main component | 200 mg |
P-903001064 | N/A | As a main component | in stock |
P-851941455 | N/A | As a main component | in stock |
P-489153989 | 97 | As a main component | in stock |
P-873293608 | 99 | As a main component | 125 g |
P-619199298 | 99 | As a main component | 200 g |
P-864155594 | 95 | As a main component | in stock |
P-904963917 | 95 | As a main component | in stock |
P-902966854 | 98 | As a main component | 51.055 g |
P-871219936 | N/A | As a main component | by resynthesis (? - ? days) |
P-901458391 | 95 | As a main component | by synthesis |
P-851247294 | 95 | As a main component | by synthesis |
P-580452136 | 98 | As a main component | in stock |
P-887323501 | 95 | As a main component | by synthesis |
P-868581434 | 98 | As a main component | in stock |
P-861300597 | 90 | As a main component | in stock |
P-870652328 | 90 | As a main component | in stock |
P-870653130 | N/A | As a main component | in stock |
P-500418694 | 98 | As a main component | in stock |
P-890852412 | 90 | As a main component | in stock |
P-596582855 | 95 | As a main component | 250 mg |
P-899781877 | 97 | As a main component | 50 mg |
P-852522410 | N/A | As a main component | in stock |
P-895218892 | 95 | As a main component | by synthesis |
P-867943046 | 95 | As a main component | in stock |
P-474022487 | 95 | As a main component | in stock |
P-881190582 | 90 | As a main component | 50 mg |
P-885534377 | 95 | As a main component | by synthesis |
P-869107646 | 95 | As a main component | by synthesis |
P-892286254 | 95 | As a main component | 698 mg |
P-888626678 | 95 | As a main component | 698 mg |
P-906782003 | 99 | As a main component | by synthesis |
P-906783134 | 98 | As a main component | by synthesis |
P-906890739 | 98 | As a main component | by synthesis |
P-611477890 | 90 | As a main component | in stock |
P-893977944 | 95 | As a main component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 321.822 |
logP | 3.6118 |
H-bond acceptors | 3 |
H-bond donors | 0 |
Rotatable bonds | 4 |
PSA | 57.78 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 88.958 |
Atoms | 37 |
Rings | 3 |
Heavy atoms | 21 |
Hydrogen atoms | 16 |
Heteroatoms | 5 |
N/O atoms | 3 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
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 |