Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1227692467
Compound
Show structure
In order to add this molecule to a collection you have to create an account.
Sign up for free
- 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-1227692467.sdf |
| SMILES | MCULE-1227692467.smiles |
| Standard InChI | MCULE-1227692467.inchi |
| InChIKey | MCULE-1227692467.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867582094 | 98 | As is | in stock |
| P-875740523 | 98 | As is | in stock |
| P-1275192103 | 98 | As is | in stock |
| P-1275156600 | 95 | As is | in stock |
| P-903070810 | 98 | As is | 1000 g |
| P-905477079 | 98 | As is | 100 g |
| P-866098512 | 95 | As is | 10.17 g |
| P-901168439 | 98 | As is | in stock |
| P-1270388016 | 98 | As is | in stock |
| P-606907690 | N/A | As is | in stock |
| P-489114515 | 97 | As is | in stock |
| P-596952802 | 98 | As is | 1.95 kg |
| P-1273249929 | 95 | As is | 23 g |
| P-864124296 | 97 | As is | in stock |
| P-889741626 | 95 | As is | 15 g |
| P-590627518 | 98 | As is | 106 g |
| P-893224465 | 95 | As is | in stock |
| P-4161963 | 90 | As is | 100 mg |
| P-454635125 | 90 | As is | in stock |
| P-425206885 | 90 | As is | in stock |
| P-19844982 | 90 | As is | in stock |
| P-851306453 | 95 | As is | by synthesis |
| P-868578261 | 98 | As is | in stock |
| P-34777415 | 90 | As is | by synthesis |
| P-580301779 | 95 | As is | by resynthesis (? - ? days) |
| P-901367587 | 97 | As is | 30 g |
| P-861934194 | 97 | As is | 284.38 g |
| P-1264334327 | 97 | As is | 110 g |
| P-590342102 | 90 | As is | 8.64 g |
| P-502447743 | 95 | As is | by synthesis |
| P-492242566 | 95 | As is | in stock |
| P-502905661 | 90 | As is | in stock |
| P-488545591 | 90 | As is | in stock |
| P-454341699 | 90 | As is | 240 mg |
| P-856014231 | 90 | As is | unavailable |
| P-14426399 | 90 | As is | 292 mg |
| P-601099467 | 95 | As is | 292 mg |
| P-580478593 | N/A | As is | by synthesis |
| P-1272584639 | N/A | As is | 10 g |
| P-852456894 | N/A | As is | by synthesis |
| P-854756061 | 95 | As is | in stock |
| P-492286107 | 95 | As is | 4.927 g |
| P-12986591 | 90 | As is | 4.927 g |
| P-454370531 | 92 | As is | in stock |
| P-500390446 | 97 | As is | by synthesis |
| P-859995617 | 95 | As is | by synthesis |
| P-18911925 | 90 | As is | in stock |
| P-896078255 | N/A | As is | 24.781 g |
| P-22784427 | 90 | As is | in stock |
| P-502349286 | 90 | As is | in stock |
| P-888452920 | 94 | As is | by resynthesis (? - ? days) |
| P-906904637 | 98 | As is | in stock |
| P-611373357 | 90 | As is | in stock |
| P-580448610 | 97 | As is | in stock |
| P-464679287 | 90 | As is | 9.349 g |
| P-374776 | 90 | As is | 9.349 g |
| P-3243231 | 90 | As is | 9.349 g |
| P-575330405 | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 215.047 |
| logP | 2.1438 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 55.12 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 45.0386 |
| Atoms | 18 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 7 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
