MCULE-8805704343-0
- 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 | 29 USD | 95 | 7 working days | Get Quote |
| 5 mg | 29 USD | 95 | 7 working days | Get Quote |
| 10 mg | 29 USD | 95 | 7 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.
| Name | File |
|---|---|
| SDF | MCULE-8805704343-0.sdf |
| SMILES | MCULE-8805704343-0.smiles |
| Standard InChI | MCULE-8805704343-0.inchi |
| InChIKey | MCULE-8805704343-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875706196 | N/A | As is | in stock |
| P-613849129 | 95 | As is | in stock |
| P-903031374 | 97 | As is | 20 g |
| P-893608999 | 90 | As is | 50.4 g |
| P-851718414 | N/A | As is | by synthesis |
| P-489216476 | 97 | As is | in stock |
| P-619202047 | 98 | As is | 20 g |
| P-895938427 | 95 | As is | by resynthesis (? - ? days) |
| P-596386361 | 90 | As is | 1000 mg |
| P-596513638 | 90 | As is | 1000 mg |
| P-904961561 | 95 | As is | in stock |
| P-590908715 | 95 | As is | by synthesis |
| P-492246931 | 95 | As is | in stock |
| P-454755125 | 90 | As is | in stock |
| P-454694848 | 90 | As is | in stock |
| P-619835497 | 90 | As is | 54 mg |
| P-436447576 | 95 | As is | 18 g |
| P-20010593 | 90 | As is | in stock |
| P-868615229 | 95 | As is | in stock |
| P-34795767 | 90 | As is | by synthesis |
| P-580775260 | 90 | As is | by resynthesis (? - ? days) |
| P-580764742 | 90 | As is | in stock |
| P-500248102 | N/A | As is | in stock |
| P-861938241 | 95 | As is | 20 g |
| P-502447192 | 95 | As is | by synthesis |
| P-502612321 | 90 | As is | in stock |
| P-492214886 | 95 | As is | in stock |
| P-563521200 | 95 | As is | 10 g |
| P-14055189 | 90 | As is | 5.8 g |
| P-601074930 | 90 | As is | 5.8 g |
| P-580507188 | N/A | As is | by synthesis |
| P-852397849 | N/A | As is | in stock |
| P-519759688 | 97 | As is | 128.3 g |
| P-428054826 | 97 | As is | 128.3 kg |
| P-895260891 | 95 | As is | by synthesis |
| P-878644265 | 98 | As is | in stock |
| P-491128069 | 95 | As is | by synthesis |
| P-424797231 | 90 | As is | in stock |
| P-869164018 | 95 | As is | by synthesis |
| P-892300106 | 95 | As is | unavailable |
| P-888659275 | 95 | As is | 202 mg |
| P-502330646 | 90 | As is | in stock |
| P-22496291 | 90 | As is | 998 mg |
| P-906794185 | 96 | As is | by synthesis |
| P-611455887 | 90 | As is | in stock |
| P-1230664 | 90 | As is | 1.531 g |
| P-3234946 | 90 | As is | 1.531 g |
| P-893648167 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 277.341 |
| logP | 3.7638 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 89.79 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 76.7379 |
| Atoms | 34 |
| Rings | 2 |
| Heavy atoms | 19 |
| Hydrogen atoms | 15 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |

