Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7361349450
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 | 7 USD | N/A | 14 working days | Get Quote |
| 5 mg | 7 USD | N/A | 14 working days | Get Quote |
| 10 mg | 7 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.
| Name | File |
|---|---|
| SDF | MCULE-7361349450.sdf |
| SMILES | MCULE-7361349450.smiles |
| Standard InChI | MCULE-7361349450.inchi |
| InChIKey | MCULE-7361349450.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-871218702 | BOC Sciences | All products | N/A | As is | by resynthesis (? - ? days) |
| P-505574865 | Bosche Scientific | Bosche Products | 98 | As is | in stock |
| P-868593734 | Combi-Blocks | Building Block in stock | 96 | As is | in stock |
| P-867667991 | A2B Chem | Predominantly Building Block in stock | 98 | As an isomer | in stock |
| P-869185074 | AK Scientific | Building Blocks | 95 | As an isomer | in stock |
| P-505354537 | AK Scientific | Building Blocks | 97 | As an isomer | in stock |
| P-505389327 | AK Scientific | Building Blocks | 98 | As an isomer | in stock |
| P-606925406 | AmBeed | In stock | N/A | As an isomer | in stock |
| P-596973979 | Angene | Building Blocks in stock | 97 | As an isomer | 600 g |
| P-864141922 | AstaTech | In Stock BBs | 95 | As an isomer | in stock |
| P-500143529 | Chemtos | In-stock Products | 95 | As an isomer | in stock |
| P-488555844 | InterBioScreen | Bioactive compounds | 92 | As an isomer | in stock |
| P-488544212 | InterBioScreen | Building Blocks | 90 | As an isomer | in stock |
| P-454364852 | Pharmeks LLC | Building Blocks | 92 | As an isomer | in stock |
| P-500371937 | Pi Chemicals | Virtual Compounds | 98 | As an isomer | by synthesis |
| P-611362514 | Toronto Research | In stock | 90 | As an isomer | in stock |
| P-855363453 | Toronto Research | In stock | 90 | As an isomer | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 785.876 |
| logP | 6.2958 |
| H-bond acceptors | 14 |
| H-bond donors | 5 |
| Rotatable bonds | 3 |
| PSA | 198.38 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 219.2298 |
| Atoms | 108 |
| Rings | 6 |
| Heavy atoms | 57 |
| Hydrogen atoms | 51 |
| Heteroatoms | 14 |
| N/O atoms | 14 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 9 |
| R/S chiral centers | 9 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 3 |
| Cis/trans stereo double bonds | 3 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
