Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7062253712
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 | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 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.
| Name | File |
|---|---|
| SDF | MCULE-7062253712.sdf |
| SMILES | MCULE-7062253712.smiles |
| Standard InChI | MCULE-7062253712.inchi |
| InChIKey | MCULE-7062253712.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875702145 | N/A | As is | in stock |
| P-590410462 | 98 | As is | in stock |
| P-903026297 | 98 | As is | 1.5 kg |
| P-865621638 | 95 | As is | by synthesis |
| P-606882909 | N/A | As is | in stock |
| P-489159839 | 97 | As is | in stock |
| P-596939427 | 99 | As is | 2.5 kg |
| P-494400195 | 95 | As is | by resynthesis (? - ? days) |
| P-1263769672 | 95 | As is | by synthesis |
| P-584627863 | 99 | As is | 175 g |
| P-901514863 | 95 | As is | by synthesis |
| P-851319639 | 95 | As is | by synthesis |
| P-868615645 | 98 | As is | in stock |
| P-862093633 | 95 | As is | 2.0944 kg |
| P-905351748 | 95 | As is | 25 g |
| P-870640109 | 97 | As is | 100 mg |
| P-596569295 | 97 | As is | 100 g |
| P-580509498 | N/A | As is | by synthesis |
| P-852487482 | N/A | As is | in stock |
| P-895223104 | 95 | As is | in stock |
| P-889865721 | 95 | As is | by synthesis |
| P-596738229 | 99 | As is | 762 g |
| P-906900839 | 98 | As is | in stock |
| P-611361146 | 90 | As is | in stock |
| P-666974780 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 148.201 |
| logP | 2.3892 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 9.23 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 46.44 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 12 |
| Heteroatoms | 1 |
| N/O atoms | 1 |
| 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 |
