Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3262204727
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 | 40 USD | 90 | 22 working days | Get Quote |
| 5 mg | 58 USD | 90 | 22 working days | Get Quote |
| 10 mg | 66 USD | N/A | 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-3262204727.sdf |
| SMILES | MCULE-3262204727.smiles |
| Standard InChI | MCULE-3262204727.inchi |
| InChIKey | MCULE-3262204727.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867428703 | N/A | As is | by synthesis |
| P-901347652 | 95 | As is | by synthesis |
| P-862394247 | 95 | As is | by synthesis |
| P-454693248 | 90 | As is | in stock |
| P-436446988 | 95 | As is | 10 g |
| P-20007776 | 90 | As is | in stock |
| P-861531194 | 95 | As is | by synthesis |
| P-34787939 | 90 | As is | by synthesis |
| P-905310001 | N/A | As is | 2.7 g |
| P-492222968 | 95 | As is | in stock |
| P-596590730 | 90 | As is | 5 g |
| P-852397341 | N/A | As is | in stock |
| P-869021846 | 95 | As is | by synthesis |
| P-492284760 | 90 | As is | 300 g |
| P-12914796 | 90 | As is | 300 g |
| P-885525764 | 95 | As is | by synthesis |
| P-34141660 | 90 | As is | in stock |
| P-33483951 | 90 | As is | in stock |
| P-502339303 | 90 | As is | in stock |
| P-22446867 | 90 | As is | 19 mg |
| P-611607121 | 90 | As is | in stock |
| P-855301947 | 90 | As is | in stock |
| P-1333849 | 90 | As is | 2.743 g |
| P-3235638 | 90 | As is | 2.743 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 222.280 |
| logP | 3.0767 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 7 |
| PSA | 35.53 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 64.0415 |
| Atoms | 34 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 18 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
