Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3238770623
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 | 103 USD | 95 | 27 working days | Get Quote |
| 5 mg | 103 USD | 95 | 27 working days | Get Quote |
| 10 mg | 103 USD | 95 | 27 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.
-
MCULE-8415793016
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3238770623.sdf |
| SMILES | MCULE-3238770623.smiles |
| Standard InChI | MCULE-3238770623.inchi |
| InChIKey | MCULE-3238770623.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867542227 | 95 | As is | in stock |
| P-875698724 | N/A | As is | in stock |
| P-590367243 | 95 | As is | in stock |
| P-903021954 | 95 | As is | 1000 mg |
| P-851896931 | N/A | As is | by synthesis |
| P-596503948 | 90 | As is | 1000 mg |
| P-870025117 | 90 | As is | 1000 mg |
| P-889808590 | 95 | As is | by synthesis |
| P-492250710 | 95 | As is | in stock |
| P-861389540 | 95 | As is | by synthesis |
| P-855946320 | 95 | As is | 5 g |
| P-852402367 | N/A | As is | in stock |
| P-854840504 | 95 | As is | by synthesis |
| P-885559566 | 95 | As is | by synthesis |
| P-873237105 | 90 | As is | in stock |
| P-23145424 | 94 | As is | by resynthesis (? - ? days) |
| P-611417775 | 90 | As is | in stock |
| P-893675152 | 95 | As is | by synthesis |
| P-617648318 | 90 | As a main component | in stock |
| P-584602463 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 170.295 |
| logP | 2.0938 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 29.26 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 57.5884 |
| Atoms | 34 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 22 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
