Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1109602132-0
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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 29 USD | 92 | 18 working days | Get Quote |
| 10 mg | 36 USD | 92 | 18 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-2365913056-0
- Component type: Main
-
1
MCULE-1013719295-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1109602132-0.sdf |
| SMILES | MCULE-1109602132-0.smiles |
| Standard InChI | MCULE-1109602132-0.inchi |
| InChIKey | MCULE-1109602132-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-34661500 | 90 | As is | in stock |
| P-889950675 | N/A | Main component | by synthesis |
| P-903215996 | 95 | Main component | 5 g |
| P-851722696 | N/A | Main component | by synthesis |
| P-611070044 | 95 | Main component | by synthesis |
| P-893361664 | 90 | Main component | 1000 mg |
| P-674211891 | 90 | Main component | 31 mg |
| P-70025 | 90 | Main component | 1.234 g |
| P-675064041 | 95 | Main component | 30 g |
| P-905258297 | 95 | Main component | by synthesis |
| P-34665931 | 90 | Main component | in stock |
| P-516895271 | 90 | Main component | in stock |
| P-864499249 | 90 | Main component | in stock |
| P-594269556 | 90 | Main component | in stock |
| P-516919892 | 95 | Main component | 760 mg |
| P-502983299 | 90 | Main component | in stock |
| P-580006234 | 95 | Main component | in stock |
| P-12370083 | 95 | Main component | 3 mg |
| P-596594147 | 90 | Main component | 1000 mg |
| P-588254638 | N/A | Main component | by synthesis |
| P-854791761 | 95 | Main component | by synthesis |
| P-620219776 | 95 | Main component | 760 mg |
| P-26406688 | 90 | Main component | 760 mg |
| P-674555279 | 92 | Main component | 300 mg |
| P-856065499 | 95 | Main component | in stock |
| P-424837780 | 90 | Main component | in stock |
| P-875269248 | 90 | Main component | 3 mg |
| P-464682438 | 90 | Main component | 667 mg |
| P-1110865 | 90 | Main component | 667 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 366.331 |
| logP | 1.5497 |
| H-bond acceptors | 10 |
| H-bond donors | 5 |
| Rotatable bonds | 2 |
| PSA | 170.61 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 98.3718 |
| Atoms | 41 |
| Rings | 4 |
| Heavy atoms | 27 |
| Hydrogen atoms | 14 |
| Heteroatoms | 10 |
| N/O atoms | 10 |
| 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 |
