MCULE-9823434055
- 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 | N/A | 10 working days | Get Quote |
5 mg | 8 USD | N/A | 10 working days | Get Quote |
10 mg | 8 USD | N/A | 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.
-
MCULE-3154590816
- Component type: Main
Name | File |
---|---|
SDF | MCULE-9823434055.sdf |
SMILES | MCULE-9823434055.smiles |
Standard InChI | MCULE-9823434055.inchi |
InChIKey | MCULE-9823434055.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867636097 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875801066 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-505404023 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-881671101 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-505395366 | AK Scientific | Building Blocks | 97 | As is | in stock |
P-856053587 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
P-596967663 | Angene | Building Blocks in stock | 98 | As is | 144 g |
P-864159081 | AstaTech | In Stock BBs | 98 | As is | in stock |
P-505528592 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-505501869 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-488543714 | InterBioScreen | Building Blocks | 90 | As is | in stock |
P-427931206 | InterBioScreen | Natural Compounds | 92 | As is | 300 mg |
P-454363660 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
P-869178059 | TargetMol | Natural Products | 95 | As is | 930 mg |
P-611486085 | Toronto Research | In stock | 90 | As is | in stock |
P-480919442 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
P-856056201 | Aldlab Chemicals | Building Block Custom Synth | 95 | As a main component | by synthesis |
P-580005983 | Innovapharm | Building Blocks | 95 | As a main component | in stock |
P-580042281 | Innovapharm | Screening Compounds | 90 | As a main component | in stock |
P-674817476 | Otava | In-House Stock Library | 90 | As a main component | 11.54 g |
Property | Value |
---|---|
Components | 1 |
Mass | 355.426 |
logP | 3.3144 |
H-bond acceptors | 5 |
H-bond donors | 0 |
Rotatable bonds | 4 |
PSA | 40.16 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 103.992 |
Atoms | 51 |
Rings | 4 |
Heavy atoms | 26 |
Hydrogen atoms | 25 |
Heteroatoms | 5 |
N/O atoms | 5 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 1 |
R/S chiral centers | 1 |
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 |