MCULE-2889748741
- 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 | 9 USD | 98 | 14 working days | Get Quote |
| 5 mg | 9 USD | 98 | 14 working days | Get Quote |
| 10 mg | 9 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-7719252916
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-2889748741.sdf |
| SMILES | MCULE-2889748741.smiles |
| Standard InChI | MCULE-2889748741.inchi |
| InChIKey | MCULE-2889748741.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867575898 | 97 | As is | in stock |
| P-875735976 | 97 | As is | in stock |
| P-597018392 | 95 | As is | unavailable |
| P-1275201251 | 98 | As is | in stock |
| P-903065673 | 98 | As is | 600 g |
| P-1270332920 | 97 | As is | in stock |
| P-606902084 | N/A | As is | in stock |
| P-489193368 | 97 | As is | in stock |
| P-489116512 | 97 | As is | in stock |
| P-596983392 | 97 | As is | 900 g |
| P-585262724 | 95 | As is | 130 g |
| P-864193418 | 95 | As is | in stock |
| P-580427374 | 95 | As is | by resynthesis (? - ? days) |
| P-905357688 | 97 | As is | 195 g |
| P-870656078 | N/A | As is | in stock |
| P-596564594 | 97 | As is | unavailable |
| P-31251671 | 90 | As is | unavailable |
| P-580496784 | N/A | As is | by synthesis |
| P-902976298 | 95 | As is | by synthesis |
| P-855396855 | 95 | As is | in stock |
| P-500388179 | 97 | As is | by synthesis |
| P-885540407 | 95 | As is | by synthesis |
| P-906758364 | 98 | As is | by synthesis |
| P-855056364 | 90 | As is | in stock |
| P-1271647633 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 138.232 |
| logP | 2.5921 |
| H-bond acceptors | 0 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 38.8 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 43.626 |
| Atoms | 19 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 10 |
| Heteroatoms | 1 |
| N/O atoms | 0 |
| 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 |

