Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2254587573
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 | 5 USD | 99 | 14 working days | Get Quote |
| 5 mg | 5 USD | 99 | 14 working days | Get Quote |
| 10 mg | 5 USD | 99 | 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-7494596350
- Component type: Main
-
1
MCULE-7175589186
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2254587573.sdf |
| SMILES | MCULE-2254587573.smiles |
| Standard InChI | MCULE-2254587573.inchi |
| InChIKey | MCULE-2254587573.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1270154234 | 95 | As is | in stock |
| P-1268835488 | 95 | As is | in stock |
| P-867547387 | 98 | Main component | in stock |
| P-875704627 | 98 | Main component | in stock |
| P-1275177061 | 99 | Main component | in stock |
| P-1275145411 | 98 | Main component | in stock |
| P-580194880 | 98 | Main component | in stock |
| P-903029416 | 99 | Main component | 5 kg |
| P-1264047959 | 98 | Main component | in stock |
| P-580199671 | 95 | Main component | 5 g |
| P-606914967 | N/A | Main component | in stock |
| P-489159140 | 97 | Main component | in stock |
| P-596940205 | 98 | Main component | 20 kg |
| P-605399416 | 95 | Main component | 1.85209 kg |
| P-864156620 | 95 | Main component | in stock |
| P-580735065 | 98 | Main component | 4.225 kg |
| P-505572553 | 98 | Main component | in stock |
| P-868593306 | 98 | Main component | in stock |
| P-580403034 | 95 | Main component | by resynthesis (? - ? days) |
| P-861987206 | 98 | Main component | 77.1333 kg |
| P-905338097 | 98 | Main component | 5.8 kg |
| P-608220597 | 99 | Main component | in stock |
| P-865986108 | 90 | Main component | 10 g |
| P-890221938 | 90 | Main component | in stock |
| P-505517100 | 95 | Main component | in stock |
| P-454416033 | 95 | Main component | 201 mg |
| P-454349198 | 95 | Main component | 201 mg |
| P-579611607 | N/A | Main component | in stock |
| P-31274791 | 90 | Main component | 10 g |
| P-856041677 | 90 | Main component | 10 g |
| P-1267087333 | 95 | Main component | 730 mg |
| P-601098854 | 95 | Main component | 184 mg |
| P-601053089 | 90 | Main component | 184 mg |
| P-580511252 | 98 | Main component | in stock |
| P-1272581171 | 95 | Main component | 50 g |
| P-852443734 | 95 | Main component | by synthesis |
| P-428093140 | 95 | Main component | in stock |
| P-904721002 | 90 | Main component | in stock |
| P-854693898 | 95 | Main component | in stock |
| P-896630098 | 95 | Main component | by synthesis |
| P-608272213 | 98 | Main component | in stock |
| P-492279927 | 95 | Main component | 599.988 g |
| P-12680873 | 90 | Main component | 599.988 g |
| P-888905937 | N/A | Main component | in stock |
| P-500403647 | 99 | Main component | by synthesis |
| P-885533215 | 95 | Main component | by synthesis |
| P-519877719 | 90 | Main component | in stock |
| P-579711617 | 98 | Main component | in stock |
| P-869175379 | 95 | Main component | in stock |
| P-892213659 | 95 | Main component | 1.003 g |
| P-892286513 | 95 | Main component | 1.003 g |
| P-892310040 | 95 | Main component | 1.003 g |
| P-502368442 | 90 | Main component | in stock |
| P-906760589 | 99 | Main component | by synthesis |
| P-489173280 | 97 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 170.162 |
| logP | 1.7375 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 66.76 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 44.0388 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 10 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
