MCULE-4610880324-0
- 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 | 7 USD | 98 | 14 working days | Get Quote |
| 5 mg | 7 USD | 98 | 14 working days | Get Quote |
| 10 mg | 7 USD | 98 | 14 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-4610880324-0.sdf |
| SMILES | MCULE-4610880324-0.smiles |
| Standard InChI | MCULE-4610880324-0.inchi |
| InChIKey | MCULE-4610880324-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867570766 | 98 | As is | in stock |
| P-875731194 | N/A | As is | in stock |
| P-881662343 | 95 | As is | in stock |
| P-590374598 | 98 | As is | in stock |
| P-903060495 | 98 | As is | 700 g |
| P-606855111 | N/A | As is | in stock |
| P-596949562 | 98 | As is | 700 g |
| P-589659027 | 95 | As is | by resynthesis (? - ? days) |
| P-864127642 | 97 | As is | in stock |
| P-590632433 | 98 | As is | 30 g |
| P-893222471 | 95 | As is | in stock |
| P-619927770 | 90 | As is | by synthesis |
| P-868613712 | 98 | As is | in stock |
| P-905350315 | 97 | As is | 100 g |
| P-862067188 | 97 | As is | 813.58 g |
| P-502527946 | 95 | As is | by synthesis |
| P-854062932 | 90 | As is | in stock |
| P-596564089 | 97 | As is | 100 g |
| P-870639508 | 97 | As is | 100 mg |
| P-580474252 | N/A | As is | by synthesis |
| P-852433927 | N/A | As is | in stock |
| P-35292804 | 90 | As is | 16.735 kg |
| P-863710295 | 95 | As is | in stock |
| P-26456407 | 90 | As is | 240 mg |
| P-617694812 | 90 | As is | 240 mg |
| P-500399047 | 98 | As is | by synthesis |
| P-889883045 | 95 | As is | by synthesis |
| P-23117326 | 90 | As is | in stock |
| P-611402597 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 178.184 |
| logP | 1.8145 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 43.37 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 48.1355 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 10 |
| 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 |

