Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
UNKNOWN STEREO
MCULE-4154251590
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 | 10 USD | 97 | 20 working days | Get Quote |
| 5 mg | 11 USD | 97 | 20 working days | Get Quote |
| 10 mg | 11 USD | 97 | 20 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-1822252441
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4154251590.sdf |
| SMILES | MCULE-4154251590.smiles |
| Standard InChI | MCULE-4154251590.inchi |
| InChIKey | MCULE-4154251590.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867538198 | 97 | As is | in stock |
| P-875693930 | 97 | As is | in stock |
| P-901191706 | 99 | As is | by synthesis |
| P-1275178949 | 98 | As is | in stock |
| P-1270399963 | 97 | As is | in stock |
| P-606862662 | N/A | As is | in stock |
| P-851150725 | 97 | As is | 75 g |
| P-895097098 | 99 | As is | 500 g |
| P-864142056 | 95 | As is | in stock |
| P-893219555 | 95 | As is | in stock |
| P-893238726 | 95 | As is | in stock |
| P-505492697 | 95 | As is | in stock |
| P-488555469 | 92 | As is | in stock |
| P-488549098 | 90 | As is | in stock |
| P-524441066 | 97 | As is | 363 mg |
| P-881193908 | 90 | As is | 50 mg |
| P-454367896 | 92 | As is | in stock |
| P-579708346 | N/A | As is | in stock |
| P-854957690 | 90 | As is | in stock |
| P-617777280 | 90 | As is | 1.531 g |
| P-617796657 | 90 | As is | 110 mg |
| P-1271628615 | 99 | As is | in stock |
| P-886517903 | 98 | Main component | in stock |
| P-890138300 | 98 | Main component | in stock |
| P-851829899 | N/A | Main component | by synthesis |
| P-865902988 | 98 | Main component | 20 mg |
| P-1275480326 | 95 | Main component | in stock |
| P-505492238 | 95 | Main component | in stock |
| P-500372178 | 98 | Main component | by synthesis |
| P-579704558 | N/A | Main component | in stock |
| P-892214970 | 95 | Main component | unavailable |
| P-892311252 | 95 | Main component | unavailable |
| P-873223055 | 90 | Main component | in stock |
| P-480893385 | 97 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 360.796 |
| logP | 1.2859 |
| H-bond acceptors | 10 |
| H-bond donors | 3 |
| Rotatable bonds | 8 |
| PSA | 151.14 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 89.5065 |
| Atoms | 45 |
| Rings | 2 |
| Heavy atoms | 24 |
| Hydrogen atoms | 21 |
| Heteroatoms | 11 |
| N/O atoms | 10 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
