MCULE-9315110212
- 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 | 5 USD | 98 | 14 working days | Get Quote |
| 5 mg | 5 USD | 98 | 14 working days | Get Quote |
| 10 mg | 5 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.
| Name | File |
|---|---|
| SDF | MCULE-9315110212.sdf |
| SMILES | MCULE-9315110212.smiles |
| Standard InChI | MCULE-9315110212.inchi |
| InChIKey | MCULE-9315110212.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867564257 | 98 | As is | in stock |
| P-875723263 | 98 | As is | in stock |
| P-1275174190 | 98 | As is | in stock |
| P-1275152451 | 95 | As is | in stock |
| P-903052986 | 98 | As is | 9 kg |
| P-905477973 | 98 | As is | 1000 g |
| P-901164351 | 98 | As is | in stock |
| P-1270339999 | 98 | As is | in stock |
| P-580238177 | 95 | As is | by synthesis |
| P-617066235 | 98 | As is | in stock |
| P-606947016 | N/A | As is | in stock |
| P-489123276 | 97 | As is | in stock |
| P-596928515 | 98 | As is | 8.5 kg |
| P-494320374 | 95 | As is | 254.8 g |
| P-864096709 | 95 | As is | in stock |
| P-889740409 | 95 | As is | 30 g |
| P-580733213 | 98 | As is | 1.015 kg |
| P-893229909 | 95 | As is | in stock |
| P-448866030 | 90 | As is | 929 mg |
| P-578527106 | 90 | As is | in stock |
| P-851269670 | 95 | As is | by synthesis |
| P-868554968 | 98 | As is | in stock |
| P-580420288 | 95 | As is | by resynthesis (? - ? days) |
| P-889111318 | 98 | As is | 267 g |
| P-905330207 | 98 | As is | 860 g |
| P-494300433 | 98 | As is | in stock |
| P-505503893 | 95 | As is | in stock |
| P-502528564 | 95 | As is | by synthesis |
| P-492237260 | 95 | As is | in stock |
| P-502905785 | 90 | As is | in stock |
| P-488548621 | 90 | As is | in stock |
| P-524161896 | 98 | As is | 500 g |
| P-855992087 | 98 | As is | 100 mg |
| P-31179833 | 90 | As is | unavailable |
| P-580515731 | 98 | As is | in stock |
| P-1272561411 | 97 | As is | 20 g |
| P-852376878 | 97 | As is | by synthesis |
| P-855401959 | 95 | As is | in stock |
| P-617692957 | 95 | As is | 1.099 g |
| P-424127893 | 90 | As is | 1.099 g |
| P-454367597 | 92 | As is | in stock |
| P-500370632 | 98 | As is | by synthesis |
| P-885523614 | 95 | As is | by synthesis |
| P-19576034 | 90 | As is | in stock |
| P-596786432 | 95 | As is | 11.3808 kg |
| P-502332548 | 90 | As is | in stock |
| P-23348066 | 94 | As is | by resynthesis (? - ? days) |
| P-906904016 | 98 | As is | in stock |
| P-906770782 | 97 | As is | by synthesis |
| P-611522373 | 90 | As is | in stock |
| P-611369437 | 90 | As is | in stock |
| P-1430135 | 90 | As is | 1.4 g |
| P-615638459 | 95 | As is | unavailable |
| P-481009589 | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 185.109 |
| logP | 1.9553 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 83.12 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 42.1813 |
| Atoms | 17 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 4 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |

