MCULE-6858336815
- 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 | 35 USD | 90 | 19 working days | Get Quote |
5 mg | 35 USD | 95 | 14 working days | Get Quote |
10 mg | 35 USD | 95 | 10 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-6858336815.sdf |
SMILES | MCULE-6858336815.smiles |
Standard InChI | MCULE-6858336815.inchi |
InChIKey | MCULE-6858336815.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867659519 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-875827931 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869342849 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-436471918 | Alinda | Building Blocks | 95 | As is | 22 g |
P-19867726 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
P-851617159 | AmBeed | On request | N/A | As is | by synthesis |
P-590850363 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
P-492260442 | ChemBridge | Building Block Library | 95 | As is | in stock |
P-4257369 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
P-454727868 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-577203808 | ChemDiv | Discovery Chemistry Library | 90 | As is | 5 mg |
P-36840 | Chemical Block | Screening Library | 90 | As is | 4 mg |
P-861528310 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-34777372 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
P-862042180 | FluoroChem | General BB | N/A | As is | in stock |
P-855976730 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
P-852532060 | Matrix Scientific | All | N/A | As is | in stock |
P-854922734 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-654295864 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
P-18924986 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-873212649 | TimTec | Building Block Collection | 90 | As is | in stock |
P-22453078 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 492 mg |
P-855357235 | Toronto Research | In stock | 90 | As is | in stock |
P-426910 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 231 mg |
P-893671211 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 254.668 |
logP | 2.9453 |
H-bond acceptors | 5 |
H-bond donors | 0 |
Rotatable bonds | 3 |
PSA | 66.13 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 69.5865 |
Atoms | 28 |
Rings | 2 |
Heavy atoms | 17 |
Hydrogen atoms | 11 |
Heteroatoms | 6 |
N/O atoms | 5 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
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 |