Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3925941144-0
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 | 22 working days | Get Quote |
| 5 mg | 6 USD | 98 | 22 working days | Get Quote |
| 10 mg | 6 USD | 98 | 22 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.
| Name | File |
|---|---|
| SDF | MCULE-3925941144-0.sdf |
| SMILES | MCULE-3925941144-0.smiles |
| Standard InChI | MCULE-3925941144-0.inchi |
| InChIKey | MCULE-3925941144-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867577605 | 98 | As is | in stock |
| P-867301429 | N/A | As is | by synthesis |
| P-875737575 | N/A | As is | in stock |
| P-881661838 | 95 | As is | in stock |
| P-590399570 | 98 | As is | in stock |
| P-903067678 | 98 | As is | 1000 g |
| P-851940663 | N/A | As is | in stock |
| P-596951637 | 98 | As is | 200 g |
| P-872728239 | 98 | As is | in stock |
| P-589653623 | 95 | As is | 88 g |
| P-869544262 | 90 | As is | 26 mg |
| P-864155611 | 95 | As is | in stock |
| P-584628349 | 98 | As is | 30 g |
| P-901550955 | 95 | As is | by synthesis |
| P-893229875 | 95 | As is | in stock |
| P-881633629 | 98 | As is | in stock |
| P-851258932 | 95 | As is | by synthesis |
| P-868607277 | 98 | As is | in stock |
| P-905350024 | 95 | As is | 25 g |
| P-862056926 | 95 | As is | 19.821 g |
| P-870660815 | N/A | As is | in stock |
| P-488545053 | 90 | As is | in stock |
| P-13965201 | 95 | As is | 300 mg |
| P-856009548 | 95 | As is | 100 mg |
| P-31178012 | 90 | As is | unavailable |
| P-856044784 | 90 | As is | unavailable |
| P-852530315 | N/A | As is | in stock |
| P-35208321 | 90 | As is | 172 g |
| P-899991094 | 95 | As is | by synthesis |
| P-865621249 | 95 | As is | in stock |
| P-584618806 | 95 | As is | in stock |
| P-608275509 | 98 | As is | in stock |
| P-424128869 | 90 | As is | 265 mg |
| P-617693047 | 95 | As is | 265 mg |
| P-454365299 | 92 | As is | in stock |
| P-13242101 | 92 | As is | 300 mg |
| P-500387739 | 98 | As is | by synthesis |
| P-885528615 | 95 | As is | by synthesis |
| P-19829869 | 90 | As is | in stock |
| P-617401851 | N/A | As is | in stock |
| P-892213682 | 95 | As is | by synthesis |
| P-869175386 | 95 | As is | in stock |
| P-892286536 | 95 | As is | 1.007 g |
| P-892310062 | 95 | As is | 1.007 g |
| P-502354495 | 90 | As is | in stock |
| P-22536430 | 90 | As is | 1000 mg |
| P-906904303 | 98 | As is | in stock |
| P-906773317 | 98 | As is | by synthesis |
| P-611379303 | 90 | As is | in stock |
| P-35134142 | 90 | As is | 119 mg |
| P-893927164 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 224.253 |
| logP | 3.3931 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 26.3 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 65.5015 |
| Atoms | 29 |
| Rings | 3 |
| Heavy atoms | 17 |
| Hydrogen atoms | 12 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
