MCULE-9947134953-0
- 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 | 6 USD | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 USD | 98 | 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-5348148750-0
- Component type: Main
-
MCULE-6278199278-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9947134953-0.sdf |
| SMILES | MCULE-9947134953-0.smiles |
| Standard InChI | MCULE-9947134953-0.inchi |
| InChIKey | MCULE-9947134953-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867557623 | 97 | As is | in stock |
| P-875717118 | N/A | As is | in stock |
| P-869185205 | 95 | As is | in stock |
| P-590401880 | 98 | As is | in stock |
| P-903045054 | 98 | As is | 400 g |
| P-893522900 | 90 | As is | 656.315 g |
| P-901166543 | 98 | As is | in stock |
| P-606906307 | N/A | As is | in stock |
| P-596943973 | 97 | As is | 200 g |
| P-895936765 | 95 | As is | by resynthesis (? - ? days) |
| P-864111268 | 97 | As is | in stock |
| P-481166093 | 95 | As is | 5 g |
| P-580720201 | 97 | As is | 162.5 g |
| P-619933238 | 90 | As is | by synthesis |
| P-861305426 | 95 | As is | 15 g |
| P-868362231 | 95 | As is | by synthesis |
| P-868579383 | 96 | As is | in stock |
| P-580422280 | 95 | As is | by resynthesis (? - ? days) |
| P-861951237 | 97 | As is | 21.6 g |
| P-905331410 | 97 | As is | 21.6 g |
| P-502469183 | 95 | As is | by synthesis |
| P-488545976 | 90 | As is | in stock |
| P-13202376 | 95 | As is | 300 mg |
| P-454349594 | 95 | As is | 100 mg |
| P-454416173 | 95 | As is | 100 g |
| P-608079918 | 95 | As is | unavailable |
| P-31179639 | 90 | As is | 5 g |
| P-856042688 | 90 | As is | 5 g |
| P-613276356 | 95 | As is | by synthesis |
| P-580464019 | N/A | As is | by synthesis |
| P-852420644 | N/A | As is | in stock |
| P-519749929 | 97 | As is | 210.1 g |
| P-428007247 | 97 | As is | 210.1 kg |
| P-854728074 | 95 | As is | in stock |
| P-579723632 | 90 | As is | in stock |
| P-888164210 | 90 | As is | in stock |
| P-620235836 | 95 | As is | 1000 mg |
| P-12961144 | 90 | As is | 1000 mg |
| P-454365997 | 92 | As is | in stock |
| P-885543632 | 95 | As is | by synthesis |
| P-18918239 | 90 | As is | in stock |
| P-502333876 | 90 | As is | in stock |
| P-611577773 | 90 | As is | in stock |
| P-893980443 | 95 | As is | in stock |
| P-886594573 | 98 | As a main component | in stock |
| P-875780095 | N/A | As a main component | in stock |
| P-869239089 | 95 | As a main component | in stock |
| P-590406659 | 95 | As a main component | in stock |
| P-893430225 | 90 | As a main component | by synthesis |
| P-851862616 | N/A | As a main component | by synthesis |
| P-489177042 | 97 | As a main component | in stock |
| P-864281690 | 95 | As a main component | by synthesis |
| P-591093359 | 95 | As a main component | by synthesis |
| P-901490846 | 95 | As a main component | by synthesis |
| P-868648417 | 98 | As a main component | in stock |
| P-580421507 | 95 | As a main component | by resynthesis (? - ? days) |
| P-855936990 | 97 | As a main component | 25 g |
| P-852380569 | N/A | As a main component | in stock |
| P-864061600 | 95 | As a main component | by synthesis |
| P-903643230 | 94 | As a main component | by resynthesis (? - ? days) |
| P-906869306 | 98 | As a main component | by synthesis |
| P-611397220 | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 176.258 |
| logP | 2.9053 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 29.26 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 60.2954 |
| Atoms | 29 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 16 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |

