Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6313957247
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 | 6 USD | 95 | 14 working days | Get Quote |
| 5 mg | 6 USD | 95 | 14 working days | Get Quote |
| 10 mg | 6 USD | 95 | 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-2536395443
- Component type: Main
-
2
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6313957247.sdf |
| SMILES | MCULE-6313957247.smiles |
| Standard InChI | MCULE-6313957247.inchi |
| InChIKey | MCULE-6313957247.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-852196063 | N/A | As is | by synthesis |
| P-489192749 | 97 | As is | in stock |
| P-901418773 | 95 | As is | by synthesis |
| P-563388532 | 97 | As is | 100 g |
| P-867563594 | 98 | Main component | in stock |
| P-875722776 | N/A | Main component | in stock |
| P-869189088 | 95 | Main component | in stock |
| P-505347863 | 98 | Main component | in stock |
| P-903052085 | 95 | Main component | 1.5 kg |
| P-606847285 | N/A | Main component | in stock |
| P-596945951 | 95 | Main component | 10 kg |
| P-494331562 | 95 | Main component | by resynthesis (? - ? days) |
| P-864085620 | 97 | Main component | in stock |
| P-851272166 | 95 | Main component | by synthesis |
| P-868554524 | 97 | Main component | in stock |
| P-580291792 | N/A | Main component | by resynthesis (? - ? days) |
| P-881681010 | N/A | Main component | by resynthesis (? - ? days) |
| P-870655825 | 98 | Main component | in stock |
| P-870656257 | N/A | Main component | in stock |
| P-870658255 | N/A | Main component | in stock |
| P-855992086 | 98 | Main component | 100 mg |
| P-454352706 | 95 | Main component | 100 mg |
| P-454331903 | 95 | Main component | 36 mg |
| P-454407956 | 95 | Main component | 25 g |
| P-524161895 | 98 | Main component | 500 g |
| P-454417329 | 95 | Main component | 500 g |
| P-579660633 | 97 | Main component | by resynthesis (? - ? days) |
| P-31274421 | 90 | Main component | 10 g |
| P-856039653 | 90 | Main component | 10 g |
| P-613282384 | 95 | Main component | by synthesis |
| P-852443404 | N/A | Main component | in stock |
| P-424124022 | 90 | Main component | 569 mg |
| P-617692647 | 95 | Main component | 569 mg |
| P-500405458 | 98 | Main component | by synthesis |
| P-885538369 | 95 | Main component | by synthesis |
| P-498639611 | 95 | Main component | by synthesis |
| P-502348513 | 90 | Main component | in stock |
| P-855007522 | 90 | Main component | in stock |
| P-666971928 | 95 | Main component | in stock |
| P-867409183 | N/A | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 173.081 |
| logP | 1.8293 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 0 |
| PSA | 24.06 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 51.3984 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 14 |
| Heteroatoms | 4 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
