Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6494267570
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 | 20 USD | 99 | 22 working days | Get Quote |
| 10 mg | 33 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-6494267570.sdf |
| SMILES | MCULE-6494267570.smiles |
| Standard InChI | MCULE-6494267570.inchi |
| InChIKey | MCULE-6494267570.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867623523 | 99 | As is | in stock |
| P-875785863 | 99 | As is | in stock |
| P-595215984 | 98 | As is | in stock |
| P-610974989 | 90 | As is | 66.119 g |
| P-1270400227 | 99 | As is | in stock |
| P-606934824 | N/A | As is | in stock |
| P-619157730 | 98 | As is | 200 mg |
| P-1273452370 | 95 | As is | by resynthesis (? - ? days) |
| P-907575055 | 98 | As is | in stock |
| P-851279906 | 95 | As is | by synthesis |
| P-861487438 | 95 | As is | by synthesis |
| P-579479968 | 95 | As is | in stock |
| P-901410993 | 99 | As is | 200 mg |
| P-868078826 | 95 | As is | in stock |
| P-855915107 | 97 | As is | 1 mg |
| P-854716606 | 95 | As is | in stock |
| P-1263153303 | 95 | As is | by synthesis |
| P-474025229 | 95 | As is | in stock |
| P-608274015 | 98 | As is | in stock |
| P-617403836 | N/A | As is | in stock |
| P-869125299 | 95 | As is | by synthesis |
| P-892290653 | 95 | As is | unavailable |
| P-888638901 | 95 | As is | 202 mg |
| P-1271682162 | 99 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 346.813 |
| logP | 3.3544 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 6 |
| PSA | 87.89 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 96.0272 |
| Atoms | 43 |
| Rings | 3 |
| Heavy atoms | 24 |
| Hydrogen atoms | 19 |
| Heteroatoms | 8 |
| 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 |
