Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5918322648
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 | 39 USD | 90 | 22 working days | Get Quote |
| 5 mg | 57 USD | 90 | 22 working days | Get Quote |
| 10 mg | 72 USD | 90 | 22 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.
| Name | File |
|---|---|
| SDF | MCULE-5918322648.sdf |
| SMILES | MCULE-5918322648.smiles |
| Standard InChI | MCULE-5918322648.inchi |
| InChIKey | MCULE-5918322648.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886608438 | 95 | As is | in stock |
| P-901197094 | N/A | As is | by synthesis |
| P-613847805 | 95 | As is | in stock |
| P-903145446 | 95 | As is | 2.5 g |
| P-893454670 | 90 | As is | 312 mg |
| P-580217359 | 95 | As is | by synthesis |
| P-851672091 | N/A | As is | by synthesis |
| P-596459032 | 90 | As is | 1000 mg |
| P-596517987 | 90 | As is | 1000 mg |
| P-889811503 | 95 | As is | by synthesis |
| P-590947319 | 95 | As is | by synthesis |
| P-454637805 | 90 | As is | in stock |
| P-436469540 | 95 | As is | in stock |
| P-861389521 | 95 | As is | by synthesis |
| P-905315283 | N/A | As is | in stock |
| P-579490337 | 90 | As is | 9.72 g |
| P-890206397 | 90 | As is | 9.72 g |
| P-588717246 | 95 | As is | 192 mg |
| P-524171944 | 95 | As is | 192 mg |
| P-888160945 | 95 | As is | 300 mg |
| P-890558932 | 90 | As is | 300 mg |
| P-588252627 | N/A | As is | by synthesis |
| P-852402749 | N/A | As is | in stock |
| P-874442588 | 95 | As is | by synthesis |
| P-12632752 | 90 | As is | 20 mg |
| P-885523205 | 95 | As is | by synthesis |
| P-424839312 | 90 | As is | in stock |
| P-502350251 | 90 | As is | in stock |
| P-22523014 | 90 | As is | 50 mg |
| P-611488869 | 90 | As is | in stock |
| P-2982839 | 90 | As is | 1.799 g |
| P-3224775 | 90 | As is | 1.799 g |
| P-893832755 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 213.659 |
| logP | 1.9411 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 38.33 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 55.3117 |
| Atoms | 26 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 12 |
| 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 |
