Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4265415009
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 | 95 | 7 working days | Get Quote |
| 5 mg | 54 USD | N/A | 22 working days | Get Quote |
| 10 mg | 69 USD | N/A | 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-4265415009.sdf |
| SMILES | MCULE-4265415009.smiles |
| Standard InChI | MCULE-4265415009.inchi |
| InChIKey | MCULE-4265415009.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867615236 | N/A | As is | in stock |
| P-875776099 | N/A | As is | in stock |
| P-869346985 | 95 | As is | by resynthesis (? - ? days) |
| P-893618063 | 90 | As is | 9.915 g |
| P-1270320746 | N/A | As is | in stock |
| P-893292178 | N/A | As is | in stock |
| P-895096944 | 98 | As is | 100 mg |
| P-1273260656 | 95 | As is | by resynthesis (? - ? days) |
| P-1273281532 | 95 | As is | by resynthesis (? - ? days) |
| P-1275490440 | 95 | As is | in stock |
| P-893280698 | 95 | As is | 186 mg |
| P-901539296 | 95 | As is | by synthesis |
| P-851266848 | 95 | As is | by synthesis |
| P-887188222 | 95 | As is | by synthesis |
| P-608495342 | 95 | As is | in stock |
| P-675214954 | 95 | As is | in stock |
| P-873249658 | 97 | As is | 5 mg |
| P-854714073 | 95 | As is | in stock |
| P-872668631 | 95 | As is | in stock |
| P-878643829 | 98 | As is | in stock |
| P-892288760 | 95 | As is | unavailable |
| P-869118207 | 95 | As is | 178 mg |
| P-888633290 | 95 | As is | 178 mg |
| P-906837345 | 98 | As is | by synthesis |
| P-1271707915 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 501.500 |
| logP | 4.1706 |
| H-bond acceptors | 8 |
| H-bond donors | 2 |
| Rotatable bonds | 10 |
| PSA | 98.66 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 130.66 |
| Atoms | 62 |
| Rings | 3 |
| Heavy atoms | 36 |
| Hydrogen atoms | 26 |
| Heteroatoms | 11 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
