Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3600340647-0
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 | 26 USD | 98 | 11 working days | Get Quote |
| 5 mg | 26 USD | 98 | 11 working days | Get Quote |
| 10 mg | 26 USD | 98 | 11 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-3868318472-0
- Component type: Main
-
MCULE-9210013428-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3600340647-0.sdf |
| SMILES | MCULE-3600340647-0.smiles |
| Standard InChI | MCULE-3600340647-0.inchi |
| InChIKey | MCULE-3600340647-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875830101 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-489116981 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-500415584 | AvaChem Scientific | On demand | 95 | As is | by synthesis |
| P-872607610 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-852463196 | Matrix Scientific | All | N/A | As is | in stock |
| P-896627240 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-854718748 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-871068947 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-875830705 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-505573379 | Bosche Scientific | Bosche Products | 98 | As a main component | in stock |
| P-851278103 | Chemshuttle | On request catalog | 95 | As a main component | by synthesis |
| P-868618543 | Combi-Blocks | Building Block in stock | 98 | As a main component | in stock |
| P-852463197 | Matrix Scientific | All | N/A | As a main component | in stock |
| P-896627752 | MedChemExpress | Screening compounds on demand | 95 | As a main component | by synthesis |
| P-854719451 | MedChemExpress | Screening compounds In stock | 95 | As a main component | in stock |
| P-474023506 | MedKoo | In stock compounds | 95 | As a main component | in stock |
| P-608276280 | Molnova | Stock | 98 | As a main component | in stock |
| P-579714304 | Paragos | In-stock compounds | N/A | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 318.334 |
| logP | 3.9018 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 10 |
| PSA | 56.84 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 78.6214 |
| Atoms | 43 |
| Rings | 1 |
| Heavy atoms | 22 |
| Hydrogen atoms | 21 |
| Heteroatoms | 7 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
