Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5352953230-0
Structure
Show compound
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 |
- 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-2834033564-0
- Component type: Main
-
1
MCULE-5726619687-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5352953230-0.sdf |
| SMILES | MCULE-5352953230-0.smiles |
| Standard InChI | MCULE-5352953230-0.inchi |
| InChIKey | MCULE-5352953230-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867589491 | 95 | Main component | in stock |
| P-875749239 | 98 | Main component | in stock |
| P-1275144193 | 95 | Main component | in stock |
| P-1275179434 | 98 | Main component | in stock |
| P-872728635 | 98 | Main component | in stock |
| P-903080201 | 98 | Main component | 4 kg |
| P-1264049653 | 98 | Main component | in stock |
| P-905480291 | 98 | Main component | 100 g |
| P-1270298933 | 95 | Main component | in stock |
| P-893337640 | 95 | Main component | by synthesis |
| P-606859691 | N/A | Main component | in stock |
| P-489185575 | 97 | Main component | in stock |
| P-596931854 | 98 | Main component | 4 kg |
| P-589657783 | 95 | Main component | by resynthesis (? - ? days) |
| P-864132019 | 95 | Main component | in stock |
| P-617552250 | 95 | Main component | by synthesis |
| P-580718782 | 95 | Main component | 1.1 kg |
| P-871221890 | N/A | Main component | by resynthesis (? - ? days) |
| P-901464160 | 95 | Main component | by synthesis |
| P-452649115 | 98 | Main component | in stock |
| P-34883706 | 90 | Main component | in stock |
| P-868577911 | 98 | Main component | in stock |
| P-579477681 | 95 | Main component | in stock |
| P-580402868 | 95 | Main component | by resynthesis (? - ? days) |
| P-861987422 | 95 | Main component | 1.16837 kg |
| P-901371181 | 95 | Main component | 254 g |
| P-905338219 | 95 | Main component | 1.975 kg |
| P-870655916 | 98 | Main component | in stock |
| P-675211253 | 95 | Main component | in stock |
| P-488556179 | 92 | Main component | in stock |
| P-488544827 | 90 | Main component | in stock |
| P-856009261 | 98 | Main component | 100 mg |
| P-1272581374 | 95 | Main component | 1000 g |
| P-852444007 | 95 | Main component | by synthesis |
| P-1275093505 | 95 | Main component | in stock |
| P-854690754 | 95 | Main component | in stock |
| P-878641131 | 98 | Main component | in stock |
| P-888888233 | N/A | Main component | in stock |
| P-454364290 | 92 | Main component | in stock |
| P-13946133 | 92 | Main component | 300 mg |
| P-500377927 | 98 | Main component | by synthesis |
| P-885524265 | 95 | Main component | by synthesis |
| P-19627394 | 90 | Main component | in stock |
| P-617402170 | 98 | Main component | in stock |
| P-896073674 | N/A | Main component | 13.602 g |
| P-869176106 | 95 | Main component | in stock |
| P-892235089 | 95 | Main component | 1000 mg |
| P-892292421 | 95 | Main component | 1000 mg |
| P-892326158 | 95 | Main component | 1000 mg |
| P-502390960 | 90 | Main component | in stock |
| P-888453740 | 94 | Main component | by resynthesis (? - ? days) |
| P-906758005 | 98 | Main component | by synthesis |
| P-3001114 | 90 | Main component | 1.596 g |
| P-480994376 | 97 | Main component | in stock |
| P-867596816 | 95 | Main component as a main component | in stock |
| P-875755736 | 98 | Main component as a main component | in stock |
| P-1275189802 | 98 | Main component as a main component | in stock |
| P-1275184487 | 95 | Main component as a main component | in stock |
| P-903090225 | N/A | Main component as a main component | 800 g |
| P-1264054738 | 99 | Main component as a main component | in stock |
| P-1274944108 | N/A | Main component as a main component | in stock |
| P-606930380 | N/A | Main component as a main component | in stock |
| P-489178956 | 97 | Main component as a main component | in stock |
| P-596958509 | 98 | Main component as a main component | 775 g |
| P-1273269474 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-864147747 | 99 | Main component as a main component | in stock |
| P-901879477 | 95 | Main component as a main component | by synthesis |
| P-892409297 | 98 | Main component as a main component | by synthesis |
| P-871221873 | N/A | Main component as a main component | by resynthesis (? - ? days) |
| P-452649112 | 98 | Main component as a main component | in stock |
| P-868597676 | 98 | Main component as a main component | in stock |
| P-1273139323 | N/A | Main component as a main component | 800 g |
| P-505527660 | 95 | Main component as a main component | in stock |
| P-524166136 | 98 | Main component as a main component | 100 mg |
| P-860796220 | N/A | Main component as a main component | in stock |
| P-888171140 | 98 | Main component as a main component | by synthesis |
| P-885539976 | 95 | Main component as a main component | by synthesis |
| P-617401961 | 98 | Main component as a main component | in stock |
| P-906837605 | 97 | Main component as a main component | by synthesis |
| P-886970567 | 98 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 234.189 |
| logP | 0.7816 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 0 |
| PSA | 113.35 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 56.1589 |
| Atoms | 30 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 15 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| 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 |
