MCULE-1511268316-0
- 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 | 29 USD | 98 | 19 working days | Get Quote |
5 mg | 29 USD | 98 | 19 working days | Get Quote |
10 mg | 37 USD | 95 | 19 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-9406007271-0
- Component type: Unknown
Name | File |
---|---|
SDF | MCULE-1511268316-0.sdf |
SMILES | MCULE-1511268316-0.smiles |
Standard InChI | MCULE-1511268316-0.inchi |
InChIKey | MCULE-1511268316-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867611615 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875770971 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-597025092 | AEchem | Building blocks | 95 | As is | in stock |
P-505388616 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-505389525 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-881671042 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-864217764 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-893227390 | Biosynth | In Stock | 95 | As is | in stock |
P-868591784 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
P-861987858 | FluoroChem | General BB | 95 | As is | in stock |
P-505512795 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-454398421 | Key Organics | Building Blocks | 90 | As is | 516 mg |
P-18781557 | Key Organics | Screening Compounds and Fragments | 90 | As is | 516 mg |
P-852444604 | Matrix Scientific | All | N/A | As is | in stock |
P-896629478 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
P-895183691 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
P-584617969 | MedKoo | In stock compounds | 95 | As is | in stock |
P-885560319 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-869126127 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
P-892290889 | TargetMol | In Stock BB | 95 | As is | unavailable |
P-888639577 | TargetMol | Screening Compounds - stock amount | 95 | As is | 22.977 g |
P-611372817 | Toronto Research | In stock | 90 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 394.294 |
logP | 5.4962 |
H-bond acceptors | 4 |
H-bond donors | 1 |
Rotatable bonds | 6 |
PSA | 51.22 |
RO5 violations | 1 |
RO3 violations | 4 |
Refractivity | 89.8852 |
Atoms | 39 |
Rings | 3 |
Heavy atoms | 28 |
Hydrogen atoms | 11 |
Heteroatoms | 9 |
N/O atoms | 4 |
Inorganic atoms | 0 |
Halogen atoms | 5 |
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 |