Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7961016535-0
Structure
Show compound
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 | 7 USD | 98 | 14 working days | Get Quote |
| 5 mg | 7 USD | 98 | 14 working days | Get Quote |
| 10 mg | 7 USD | 98 | 14 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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.
-
1
MCULE-6177129889-0
- Component type: Main
-
1
MCULE-6124492894-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7961016535-0.sdf |
| SMILES | MCULE-7961016535-0.smiles |
| Standard InChI | MCULE-7961016535-0.inchi |
| InChIKey | MCULE-7961016535-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867446667 | N/A | As is | by synthesis |
| P-35215202 | 90 | As is | 9.718 kg |
| P-896119816 | 90 | As is | unavailable |
| P-867575872 | 98 | Main component | in stock |
| P-875736102 | N/A | Main component | in stock |
| P-590384404 | 95 | Main component | in stock |
| P-903065742 | 98 | Main component | 20 g |
| P-905480614 | 97 | Main component | 1000 mg |
| P-893512508 | 90 | Main component | 54.104 g |
| P-901168057 | 98 | Main component | in stock |
| P-606832483 | N/A | Main component | in stock |
| P-489127346 | 97 | Main component | in stock |
| P-596975800 | 98 | Main component | 15 g |
| P-494351633 | 95 | Main component | 2 g |
| P-864109011 | 95 | Main component | in stock |
| P-481166235 | 95 | Main component | 500 mg |
| P-580704317 | 98 | Main component | 41 g |
| P-893252540 | 95 | Main component | by synthesis |
| P-504778209 | 90 | Main component | 5 mg |
| P-454691283 | 90 | Main component | in stock |
| P-188470 | 90 | Main component | 5 mg |
| P-436446045 | 95 | Main component | 1000 mg |
| P-20025953 | 90 | Main component | in stock |
| P-851266689 | 95 | Main component | by synthesis |
| P-861275411 | 95 | Main component | in stock |
| P-868643122 | 98 | Main component | in stock |
| P-34838601 | 90 | Main component | in stock |
| P-580775059 | 90 | Main component | by resynthesis (? - ? days) |
| P-580764547 | 90 | Main component | in stock |
| P-580299445 | 95 | Main component | by resynthesis (? - ? days) |
| P-861931899 | 95 | Main component | 20.604 g |
| P-502773243 | 90 | Main component | in stock |
| P-492221361 | 95 | Main component | in stock |
| P-18800854 | 95 | Main component | 70.523 g |
| P-454382420 | 95 | Main component | 70.523 g |
| P-580470214 | N/A | Main component | by synthesis |
| P-852396695 | N/A | Main component | in stock |
| P-854732447 | 95 | Main component | in stock |
| P-579724529 | 90 | Main component | in stock |
| P-888164662 | 90 | Main component | in stock |
| P-12632447 | 90 | Main component | 49 mg |
| P-856064933 | 95 | Main component | in stock |
| P-19203077 | 90 | Main component | in stock |
| P-596758834 | 98 | Main component | 82 g |
| P-33464949 | 90 | Main component | in stock |
| P-502341608 | 90 | Main component | in stock |
| P-888432604 | 94 | Main component | by resynthesis (? - ? days) |
| P-611376648 | 90 | Main component | in stock |
| P-3230797 | 90 | Main component | 1.899 g |
| P-25600594 | 90 | Main component | 1.899 g |
| P-893940377 | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 291.596 |
| logP | 4.585 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 67.15 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 67.0034 |
| Atoms | 22 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 8 |
| Heteroatoms | 5 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
