MCULE-9352227082-0
- 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 | 20 USD | 98 | 19 working days | Get Quote |
| 5 mg | 20 USD | 98 | 19 working days | Get Quote |
| 10 mg | 20 USD | 98 | 19 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-6770228697-0
- Component type: Unknown
-
MCULE-3012145331-0
- Component type: Unknown
-
MCULE-1713396863-0
- Component type: Main
-
MCULE-5974671008-0
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-9352227082-0.sdf |
| SMILES | MCULE-9352227082-0.smiles |
| Standard InChI | MCULE-9352227082-0.inchi |
| InChIKey | MCULE-9352227082-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867566183 | 98 | As is | in stock |
| P-875726252 | N/A | As is | in stock |
| P-588245781 | 98 | As is | in stock |
| P-489141992 | 97 | As is | in stock |
| P-895930481 | 95 | As is | by resynthesis (? - ? days) |
| P-895930483 | 95 | As is | by resynthesis (? - ? days) |
| P-895930482 | 95 | As is | by resynthesis (? - ? days) |
| P-895930485 | 95 | As is | by resynthesis (? - ? days) |
| P-895930486 | 95 | As is | by resynthesis (? - ? days) |
| P-895930484 | 95 | As is | by resynthesis (? - ? days) |
| P-901432442 | 95 | As is | by synthesis |
| P-901447456 | 95 | As is | by synthesis |
| P-901492374 | 95 | As is | by synthesis |
| P-901546270 | 95 | As is | by synthesis |
| P-893220775 | 95 | As is | in stock |
| P-893236048 | 95 | As is | in stock |
| P-870659138 | N/A | As is | in stock |
| P-856039474 | 90 | As is | 10 g |
| P-31275061 | 90 | As is | 10 g |
| P-613283745 | 95 | As is | by synthesis |
| P-860789068 | 98 | As is | by synthesis |
| P-852505888 | N/A | As is | in stock |
| P-888171929 | 98 | As is | by synthesis |
| P-620223878 | 95 | As is | 1000 mg |
| P-620069171 | 90 | As is | 1000 mg |
| P-885516522 | 95 | As is | by synthesis |
| P-903644836 | 94 | As is | by resynthesis (? - ? days) |
| P-611359823 | 90 | As is | in stock |
| P-855254100 | 90 | As is | in stock |
| P-893111176 | N/A | As a main component | by synthesis |
| P-901268608 | N/A | As a component | in stock |
| P-893236049 | 95 | As a component | in stock |
| P-874441081 | 95 | As a component | by synthesis |
| P-611359824 | 90 | As a component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 72.062 |
| logP | 0.257 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 37.3 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 17.8328 |
| Atoms | 9 |
| Rings | 0 |
| Heavy atoms | 5 |
| Hydrogen atoms | 4 |
| 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 |

