MCULE-7087694761
- 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 | 50 USD | 90 | 19 working days | Get Quote |
5 mg | 73 USD | 90 | 19 working days | Get Quote |
10 mg | 91 USD | 90 | 19 working days | Get Quote |
- 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-7087694761.sdf |
SMILES | MCULE-7087694761.smiles |
Standard InChI | MCULE-7087694761.inchi |
InChIKey | MCULE-7087694761.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-904306531 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | As is | by synthesis |
P-851690422 | AmBeed | On request | N/A | As is | by synthesis |
P-851844550 | AmBeed | On request | N/A | As is | by synthesis |
P-489165553 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-605394600 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-864157104 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-591010435 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-591000939 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-5102332 | ChemDiv | Discovery Chemistry Library | 90 | As is | 43 mg |
P-254754 | Chemical Block | Screening Library | 90 | As is | 35 mg |
P-868546341 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-887190754 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-34705414 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
P-580333604 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-615633699 | LabNetwork | In stock | 95 | As is | in stock |
P-852633245 | Matrix Scientific | All | N/A | As is | in stock |
P-35161549 | Maybridge | Screening Collection | 90 | As is | 1.918 kg |
P-895245700 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-888876172 | PharmaBlock | In stock | N/A | As is | in stock |
P-24050631 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-596770372 | Synthonix | In-stock Building Blocks | 95 | As is | 264.11 g |
P-22605025 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
P-855341361 | Toronto Research | In stock | 90 | As is | in stock |
P-2135911 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 30 mg |
P-615424935 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 262.218 |
logP | 2.1362 |
H-bond acceptors | 7 |
H-bond donors | 1 |
Rotatable bonds | 4 |
PSA | 104.98 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 69.4772 |
Atoms | 29 |
Rings | 2 |
Heavy atoms | 19 |
Hydrogen atoms | 10 |
Heteroatoms | 7 |
N/O atoms | 7 |
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 |