Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4868090831-0
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 | 2 USD | N/A | 14 working days | Get Quote |
| 5 mg | 2 USD | N/A | 14 working days | Get Quote |
| 10 mg | 2 USD | N/A | 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-2198445125-0
- Component type: Main
-
1
MCULE-7728164114-0
- Component type: Counter Ion
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4868090831-0.sdf |
| SMILES | MCULE-4868090831-0.smiles |
| Standard InChI | MCULE-4868090831-0.inchi |
| InChIKey | MCULE-4868090831-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867589516 | 99 | As is | in stock |
| P-875749271 | N/A | As is | in stock |
| P-869317445 | 99 | As is | in stock |
| P-505389693 | 99 | As is | in stock |
| P-903080745 | N/A | As is | 5.5 kg |
| P-905480205 | 95 | As is | 10 g |
| P-606877112 | N/A | As is | in stock |
| P-596955790 | N/A | As is | 25 kg |
| P-580194738 | 98 | As is | in stock |
| P-494305430 | 95 | As is | unavailable |
| P-864139234 | 95 | As is | in stock |
| P-580696463 | 99 | As is | 2.72 kg |
| P-893237873 | 95 | As is | in stock |
| P-452661195 | 98 | As is | in stock |
| P-580450172 | 99 | As is | in stock |
| P-868610703 | 98 | As is | in stock |
| P-905323032 | 95 | As is | 129 g |
| P-500418208 | 99 | As is | in stock |
| P-870662201 | 98 | As is | in stock |
| P-890852289 | 90 | As is | in stock |
| P-596548722 | 99 | As is | 10.044 g |
| P-579616716 | 95 | As is | unavailable |
| P-856045130 | 90 | As is | 10 g |
| P-31179752 | 90 | As is | 10 g |
| P-613333254 | 95 | As is | by synthesis |
| P-131224213 | 90 | As is | 4.959 g |
| P-580503071 | 98 | As is | by synthesis |
| P-896627162 | 95 | As is | by synthesis |
| P-854693709 | 95 | As is | in stock |
| P-474027907 | 95 | As is | in stock |
| P-608276554 | 98 | As is | in stock |
| P-881190222 | 90 | As is | 50 mg |
| P-885559380 | 95 | As is | by synthesis |
| P-579711518 | N/A | As is | in stock |
| P-892213974 | 95 | As is | by synthesis |
| P-869175477 | 95 | As is | in stock |
| P-892286834 | 95 | As is | 907 mg |
| P-892310340 | 95 | As is | 907 mg |
| P-502327424 | 90 | As is | in stock |
| P-33162042 | 90 | As is | 106 mg |
| P-906904642 | 98 | As is | in stock |
| P-906776937 | 99 | As is | by synthesis |
| P-666977080 | 95 | As is | in stock |
| P-892960693 | N/A | Main component as a main component | by synthesis |
| P-867661488 | 98 | Main component as a main component | in stock |
| P-875830428 | N/A | Main component as a main component | in stock |
| P-869187989 | 95 | Main component as a main component | in stock |
| P-505393435 | 98 | Main component as a main component | in stock |
| P-903205517 | 98 | Main component as a main component | 4 kg |
| P-606930405 | N/A | Main component as a main component | in stock |
| P-489128744 | 97 | Main component as a main component | in stock |
| P-596972753 | 98 | Main component as a main component | 5 kg |
| P-864154490 | 95 | Main component as a main component | in stock |
| P-580701305 | 98 | Main component as a main component | 102 g |
| P-505572706 | 98 | Main component as a main component | in stock |
| P-617326193 | 90 | Main component as a main component | in stock |
| P-868593917 | 97 | Main component as a main component | in stock |
| P-580759990 | 90 | Main component as a main component | by synthesis |
| P-868662735 | 95 | Main component as a main component | in stock |
| P-905319468 | 95 | Main component as a main component | in stock |
| P-505492791 | 95 | Main component as a main component | in stock |
| P-856009162 | 98 | Main component as a main component | unavailable |
| P-579616384 | 95 | Main component as a main component | 1000 g |
| P-856045129 | 90 | Main component as a main component | 10 g |
| P-31188981 | 90 | Main component as a main component | 10 g |
| P-852466026 | N/A | Main component as a main component | in stock |
| P-904060090 | 95 | Main component as a main component | by synthesis |
| P-854692548 | 95 | Main component as a main component | in stock |
| P-888170980 | 98 | Main component as a main component | by synthesis |
| P-500375751 | 98 | Main component as a main component | by synthesis |
| P-889869168 | 95 | Main component as a main component | by synthesis |
| P-869144014 | 95 | Main component as a main component | by synthesis |
| P-892302963 | 95 | Main component as a main component | in stock |
| P-892292926 | 95 | Main component as a main component | 3.037 g |
| P-888647926 | 95 | Main component as a main component | 3.037 g |
| P-502366191 | 90 | Main component as a main component | in stock |
| P-873228251 | 90 | Main component as a main component | in stock |
| P-596710260 | 90 | Main component as a main component | 36 mg |
| P-855314763 | 90 | Main component as a main component | in stock |
| P-868495298 | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 337.268 |
| logP | -1.0051 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 104.15 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 87.1882 |
| Atoms | 38 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 18 |
| Heteroatoms | 8 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
