MCULE-3074160312
- 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 | 95 | 18 working days | Get Quote |
5 mg | 35 USD | 95 | 18 working days | Get Quote |
10 mg | 39 USD | 95 | 11 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-6482552340
- Component type: Main
Name | File |
---|---|
SDF | MCULE-3074160312.sdf |
SMILES | MCULE-3074160312.smiles |
Standard InChI | MCULE-3074160312.inchi |
InChIKey | MCULE-3074160312.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867546152 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-875702637 | AA Blocks | AA Blocks | N/A | As is | in stock |
P-869191424 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-505393297 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-610959822 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 725 mg |
P-851419319 | AmBeed | On request | N/A | As is | by synthesis |
P-489127561 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-596991252 | Angene | Building Blocks in stock | 99 | As is | 9.89 g |
P-580194551 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
P-864179082 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-500415036 | AvaChem Scientific | All products | 95 | As is | by synthesis |
P-851253320 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-887091244 | Combi-Blocks | Building Block in stock | 96 | As is | in stock |
P-579480755 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
P-505497691 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-615649962 | LabNetwork | In stock | 95 | As is | in stock |
P-579617238 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
P-852525149 | Matrix Scientific | All | N/A | As is | in stock |
P-854720409 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
P-474021742 | MedKoo | In stock compounds | 95 | As is | in stock |
P-608272129 | Molnova | Stock | 98 | As is | in stock |
P-579714312 | Paragos | In-stock compounds | N/A | As is | in stock |
P-885542072 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-888657416 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
P-869162022 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
P-611409050 | Toronto Research | In stock | 90 | As is | in stock |
P-666966835 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 551.616 |
logP | 5.3577 |
H-bond acceptors | 11 |
H-bond donors | 2 |
Rotatable bonds | 11 |
PSA | 154.03 |
RO5 violations | 3 |
RO3 violations | 5 |
Refractivity | 144.9105 |
Atoms | 68 |
Rings | 4 |
Heavy atoms | 39 |
Hydrogen atoms | 29 |
Heteroatoms | 12 |
N/O atoms | 11 |
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 |