Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1007409241
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 | 20 USD | 99 | 22 working days | Get Quote |
| 5 mg | 39 USD | 99 | 22 working days | Get Quote |
| 10 mg | 54 USD | 99 | 22 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-1007409241.sdf |
| SMILES | MCULE-1007409241.smiles |
| Standard InChI | MCULE-1007409241.inchi |
| InChIKey | MCULE-1007409241.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867649132 | 99 | As is | in stock |
| P-875816580 | 99 | As is | in stock |
| P-590362451 | 98 | As is | by resynthesis (? - ? days) |
| P-505401939 | 95 | As is | by resynthesis (? - ? days) |
| P-580195499 | 98 | As is | in stock |
| P-903179267 | 98 | As is | 300 mg |
| P-893509807 | 90 | As is | 11.041 g |
| P-1270314914 | 99 | As is | in stock |
| P-606913957 | N/A | As is | in stock |
| P-619201813 | 99 | As is | 250 mg |
| P-1273268759 | 95 | As is | by resynthesis (? - ? days) |
| P-905461356 | 95 | As is | in stock |
| P-868544898 | 99 | As is | in stock |
| P-901543346 | 95 | As is | by synthesis |
| P-851278755 | 95 | As is | by synthesis |
| P-860799238 | 98 | As is | in stock |
| P-861370493 | 95 | As is | by synthesis |
| P-579479739 | 95 | As is | in stock |
| P-854621108 | 98 | As is | in stock |
| P-868079312 | 95 | As is | in stock |
| P-1273108898 | 95 | As is | 100 mg |
| P-854721669 | 95 | As is | in stock |
| P-584625449 | 95 | As is | in stock |
| P-474025406 | 95 | As is | in stock |
| P-608277787 | 98 | As is | in stock |
| P-19308087 | 90 | As is | in stock |
| P-589631508 | 98 | As is | in stock |
| P-579712608 | 98 | As is | in stock |
| P-892290952 | 95 | As is | unavailable |
| P-869126453 | 95 | As is | 26 mg |
| P-888639832 | 95 | As is | 26 mg |
| P-1271688761 | 99 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 440.313 |
| logP | 3.9111 |
| H-bond acceptors | 7 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 90.71 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 104.9937 |
| Atoms | 44 |
| Rings | 3 |
| Heavy atoms | 26 |
| Hydrogen atoms | 18 |
| Heteroatoms | 9 |
| N/O atoms | 7 |
| 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 |
