MCULE-6532857372
- 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 | 19 USD | 92 | 18 working days | Get Quote |
5 mg | 29 USD | 92 | 18 working days | Get Quote |
10 mg | 31 USD | 95 | 8 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-6532857372.sdf |
SMILES | MCULE-6532857372.smiles |
Standard InChI | MCULE-6532857372.inchi |
InChIKey | MCULE-6532857372.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867581681 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875740434 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-590396975 | AK Scientific | Building Blocks | 97 | As is | in stock |
P-610992505 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 21.1 g |
P-893300077 | Allbio Pharm | In stock | N/A | As is | in stock |
P-851533687 | AmBeed | On request | N/A | As is | by synthesis |
P-597008018 | Angene | Building Blocks in stock | 95 | As is | 10 g |
P-869398979 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-892505024 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 9.4 g |
P-590794924 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-851248223 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-868612103 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
P-580332900 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-889298131 | FluoroChem | General BB | 95 | As is | in stock |
P-12993797 | InterBioScreen | Screening Compounds | 92 | As is | 238 mg |
P-596571151 | Key Organics | Building Blocks | 97 | As is | 5 g |
P-31210334 | LaboTest | Screening Collection | 90 | As is | unavailable |
P-588250518 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
P-852503453 | Matrix Scientific | All | N/A | As is | in stock |
P-854795344 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-674657329 | Pharmeks LLC | Synthetic compounds | 92 | As is | 238 mg |
P-18936077 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-611483137 | Toronto Research | In stock | 90 | As is | in stock |
P-3243825 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 128 mg |
P-471676 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 128 mg |
P-615457618 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 244.285 |
logP | 2.7665 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 5 |
PSA | 38.69 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 70.0408 |
Atoms | 34 |
Rings | 2 |
Heavy atoms | 18 |
Hydrogen atoms | 16 |
Heteroatoms | 3 |
N/O atoms | 3 |
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 |