MCULE-7868643947
- 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 | 8 USD | 98 | 14 working days | Get Quote |
5 mg | 8 USD | 98 | 14 working days | Get Quote |
10 mg | 8 USD | 98 | 14 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-7868643947.sdf |
SMILES | MCULE-7868643947.smiles |
Standard InChI | MCULE-7868643947.inchi |
InChIKey | MCULE-7868643947.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867586686 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-875745152 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-590362201 | AK Scientific | Building Blocks | 97 | As is | in stock |
P-903075942 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As is | 30 g |
P-610977153 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 494.82 g |
P-436469215 | Alinda | Building Blocks | 95 | As is | 50 g |
P-606835810 | AmBeed | In stock | N/A | As is | in stock |
P-596954431 | Angene | Building Blocks in stock | 95 | As is | 20 g |
P-864100084 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-590622605 | BLD pharm | In-stock building blocks | 95 | As is | 11.25 g |
P-454633687 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-868567228 | Combi-Blocks | Building Block in stock | 96 | As is | in stock |
P-580436797 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-575331641 | EvoBlocks | In-stock Building Blocks | 95 | As is | in stock |
P-889111101 | FluoroChem | In Stock BB | N/A | As is | 20 g |
P-505497222 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-502537551 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
P-563532801 | Key Organics | Building Blocks | 95 | As is | 5 g |
P-891668696 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
P-862532477 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
P-852448563 | Matrix Scientific | All | N/A | As is | in stock |
P-854749748 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
P-889876506 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-596770209 | Synthonix | In-stock Building Blocks | 95 | As is | 351.53 g |
P-502382215 | TimTec | Building Block Collection | 90 | As is | in stock |
P-611457515 | Toronto Research | In stock | 90 | As is | in stock |
P-893937819 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 226.654 |
logP | 2.4759 |
H-bond acceptors | 3 |
H-bond donors | 0 |
Rotatable bonds | 5 |
PSA | 43.37 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 57.3525 |
Atoms | 26 |
Rings | 1 |
Heavy atoms | 15 |
Hydrogen atoms | 11 |
Heteroatoms | 4 |
N/O atoms | 3 |
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 |