Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2828680057
Compound
Show structures
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 | 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 |
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.
-
1
MCULE-6095227778
- Component type: Main
-
1
MCULE-8295936189
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2828680057.sdf |
| SMILES | MCULE-2828680057.smiles |
| Standard InChI | MCULE-2828680057.inchi |
| InChIKey | MCULE-2828680057.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-852071662 | N/A | As is | by synthesis |
| P-901184802 | N/A | As is | by synthesis |
| P-889750719 | 95 | As is | 138 g |
| P-871220826 | N/A | As is | by resynthesis (? - ? days) |
| P-899785428 | 97 | As is | 1000 mg |
| P-895724567 | 95 | As is | by synthesis |
| P-869184056 | 98 | Main component | in stock |
| P-590379232 | 99 | Main component | in stock |
| P-901166432 | 98 | Main component | in stock |
| P-851946467 | N/A | Main component | in stock |
| P-489129926 | 97 | Main component | in stock |
| P-890849251 | 95 | Main component | in stock |
| P-856039731 | 90 | Main component | 10 g |
| P-31273863 | 90 | Main component | 10 g |
| P-613284259 | 95 | Main component | by synthesis |
| P-852505377 | N/A | Main component | in stock |
| P-904639619 | 95 | Main component | in stock |
| P-621857882 | 90 | Main component | by synthesis |
| P-620224156 | 95 | Main component | 1000 mg |
| P-34030751 | 90 | Main component | 1000 mg |
| P-885536628 | 95 | Main component | by synthesis |
| P-502368082 | 90 | Main component | in stock |
| P-888578363 | 94 | Main component | by resynthesis (? - ? days) |
| P-855013232 | 90 | Main component | in stock |
| P-893174867 | N/A | Main component as a main component | by synthesis |
| P-892884610 | 98 | Main component as a main component | in stock |
| P-893165736 | N/A | Main component as a main component | by synthesis |
| P-867546398 | 98 | Main component as a main component | in stock |
| P-901232377 | N/A | Main component as a main component | by synthesis |
| P-875703038 | N/A | Main component as a main component | in stock |
| P-875704100 | N/A | Main component as a main component | in stock |
| P-881661089 | 95 | Main component as a main component | in stock |
| P-869305375 | 98 | Main component as a main component | in stock |
| P-869245366 | 98 | Main component as a main component | in stock |
| P-903028923 | 97 | Main component as a main component | 75 g |
| P-903341772 | 98 | Main component as a main component | 100 g |
| P-903027953 | 98 | Main component as a main component | 125 g |
| P-893551476 | 90 | Main component as a main component | 102 g |
| P-905003876 | N/A | Main component as a main component | by synthesis |
| P-1263076897 | N/A | Main component as a main component | in stock |
| P-606930342 | N/A | Main component as a main component | in stock |
| P-851952405 | N/A | Main component as a main component | in stock |
| P-596981849 | 98 | Main component as a main component | 100 g |
| P-892193234 | 98 | Main component as a main component | 2.7 kg |
| P-596986583 | 98 | Main component as a main component | 75 g |
| P-895923796 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-895930293 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-864198227 | 95 | Main component as a main component | in stock |
| P-896030479 | 95 | Main component as a main component | in stock |
| P-864198223 | 95 | Main component as a main component | in stock |
| P-619605372 | 98 | Main component as a main component | 16.225 g |
| P-905545781 | 95 | Main component as a main component | by synthesis |
| P-617324008 | 90 | Main component as a main component | in stock |
| P-901648978 | 98 | Main component as a main component | in stock |
| P-868617856 | 98 | Main component as a main component | in stock |
| P-887111361 | 98 | Main component as a main component | in stock |
| P-580443956 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-889309067 | 97 | Main component as a main component | 99.87 g |
| P-596567567 | 97 | Main component as a main component | 5 g |
| P-855931696 | 97 | Main component as a main component | 5 g |
| P-899784275 | 97 | Main component as a main component | 100 g |
| P-899783820 | 97 | Main component as a main component | 10 g |
| P-889852614 | N/A | Main component as a main component | in stock |
| P-889852615 | N/A | Main component as a main component | in stock |
| P-854744914 | 95 | Main component as a main component | in stock |
| P-900998970 | 95 | Main component as a main component | in stock |
| P-905132926 | 95 | Main component as a main component | in stock |
| P-889868116 | 95 | Main component as a main component | by synthesis |
| P-889868173 | 95 | Main component as a main component | by synthesis |
| P-873280900 | N/A | Main component as a main component | in stock |
| P-502329300 | 90 | Main component as a main component | in stock |
| P-906897683 | N/A | Main component as a main component | by synthesis |
| P-906897766 | N/A | Main component as a main component | by synthesis |
| P-906768394 | 98 | Main component as a main component | by synthesis |
| P-906760458 | 98 | Main component as a main component | by synthesis |
| P-906760083 | 98 | Main component as a main component | by synthesis |
| P-611449408 | 90 | Main component as a main component | in stock |
| P-611449409 | 90 | Main component as a main component | in stock |
| P-894006199 | 95 | Main component as a main component | in stock |
| P-615402763 | 95 | Main component as a main component | in stock |
| P-666976198 | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 189.295 |
| logP | 3.0968 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 6 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 56.7772 |
| Atoms | 36 |
| Rings | 0 |
| Heavy atoms | 13 |
| Hydrogen atoms | 23 |
| 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 |
