Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8173630214
Compound
Show structure
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 | 84 USD | 98 | 20 working days | Get Quote |
| 5 mg | 84 USD | 98 | 20 working days | Get Quote |
| 10 mg | 84 USD | 98 | 20 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-8173630214.sdf |
| SMILES | MCULE-8173630214.smiles |
| Standard InChI | MCULE-8173630214.inchi |
| InChIKey | MCULE-8173630214.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867675005 | 95 | As is | in stock |
| P-875851133 | N/A | As is | in stock |
| P-869357585 | 95 | As is | in stock |
| P-903274661 | 98 | As is | 2 g |
| P-893459480 | 90 | As is | 10 g |
| P-870135964 | N/A | As is | in stock |
| P-873299049 | 98 | As is | 5 g |
| P-864155336 | 95 | As is | in stock |
| P-869375677 | 98 | As is | 1.12 g |
| P-901531444 | 95 | As is | by synthesis |
| P-861351305 | 95 | As is | by synthesis |
| P-889328219 | 98 | As is | 5 g |
| P-563528053 | 95 | As is | 1000 mg |
| P-854856867 | 95 | As is | by synthesis |
| P-611565833 | 90 | As is | in stock |
| P-872754717 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 149.193 |
| logP | 1.8258 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 51.8 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 43.8684 |
| Atoms | 22 |
| Rings | 2 |
| Heavy atoms | 11 |
| Hydrogen atoms | 11 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
