Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5338576348-0
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 | 36 USD | 95 | 10 working days | Get Quote |
| 5 mg | 36 USD | 95 | 10 working days | Get Quote |
| 10 mg | 36 USD | 95 | 10 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-8043792094-0
- Component type: Main
-
1
MCULE-9976402631-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5338576348-0.sdf |
| SMILES | MCULE-5338576348-0.smiles |
| Standard InChI | MCULE-5338576348-0.inchi |
| InChIKey | MCULE-5338576348-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867668611 | 95 | As is | in stock |
| P-875842657 | N/A | As is | in stock |
| P-869309420 | 95 | As is | in stock |
| P-851458828 | N/A | As is | by synthesis |
| P-611028426 | 95 | As is | by synthesis |
| P-616225257 | 95 | As is | in stock |
| P-4138797 | 90 | As is | 50 mg |
| P-870581533 | 95 | As is | in stock |
| P-855949691 | 95 | As is | 1000 mg |
| P-895454220 | 95 | As is | by synthesis |
| P-893671528 | 95 | As is | by synthesis |
| P-867646812 | 95 | Main component | in stock |
| P-875813830 | N/A | Main component | in stock |
| P-613855492 | 95 | Main component | in stock |
| P-903176226 | 95 | Main component | 15 g |
| P-893447565 | 90 | Main component | 15 g |
| P-851953376 | N/A | Main component | in stock |
| P-865923893 | 95 | Main component | 15 g |
| P-889584322 | 95 | Main component | in stock |
| P-674402362 | 95 | Main component | 1.35 g |
| P-851291331 | 95 | Main component | by synthesis |
| P-861444425 | 95 | Main component | by synthesis |
| P-890218118 | 90 | Main component | 1000 mg |
| P-590340550 | 90 | Main component | 1000 mg |
| P-502548120 | 95 | Main component | by synthesis |
| P-502793161 | 90 | Main component | in stock |
| P-492219360 | 95 | Main component | in stock |
| P-855961045 | 95 | Main component | 1000 mg |
| P-889737713 | 95 | Main component | 10 g |
| P-131198145 | 90 | Main component | 3 mg |
| P-852510957 | N/A | Main component | in stock |
| P-895294760 | 95 | Main component | by synthesis |
| P-13107395 | 90 | Main component | 50 mg |
| P-888893997 | N/A | Main component | in stock |
| P-19211892 | 90 | Main component | in stock |
| P-502354065 | 90 | Main component | in stock |
| P-22531564 | 90 | Main component | 100 mg |
| P-611392199 | 90 | Main component | in stock |
| P-855347307 | 90 | Main component | in stock |
| P-893968794 | 95 | Main component | in stock |
| P-886916305 | 95 | Main component | by synthesis |
| P-867633314 | 98 | Main component as a main component | in stock |
| P-875797907 | N/A | Main component as a main component | in stock |
| P-851668848 | N/A | Main component as a main component | by synthesis |
| P-489136464 | 97 | Main component as a main component | in stock |
| P-590893371 | 95 | Main component as a main component | by synthesis |
| P-619933762 | 90 | Main component as a main component | by synthesis |
| P-584594283 | 95 | Main component as a main component | in stock |
| P-868633941 | 95 | Main component as a main component | in stock |
| P-580784339 | 90 | Main component as a main component | by resynthesis (? - ? days) |
| P-884915503 | 95 | Main component as a main component | by synthesis |
| P-852396122 | N/A | Main component as a main component | in stock |
| P-874442564 | 95 | Main component as a main component | by synthesis |
| P-502440196 | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 316.275 |
| logP | 3.2569 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 75.36 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 76.4965 |
| Atoms | 37 |
| Rings | 3 |
| Heavy atoms | 22 |
| Hydrogen atoms | 15 |
| Heteroatoms | 8 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
