MCULE-1165672669
- 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 | 5 USD | 95 | 14 working days | Get Quote |
5 mg | 5 USD | 95 | 14 working days | Get Quote |
10 mg | 5 USD | 95 | 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-1165672669.sdf |
SMILES | MCULE-1165672669.smiles |
Standard InChI | MCULE-1165672669.inchi |
InChIKey | MCULE-1165672669.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867591228 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
P-875749661 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-597016378 | AEchem | Building blocks | 97 | As is | in stock |
P-869191670 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-505395982 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-580243958 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
P-606933227 | AmBeed | In stock | N/A | As is | in stock |
P-596955848 | Angene | Building Blocks in stock | 98 | As is | 3.5 kg |
P-611625778 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-864088436 | AstaTech | In Stock BBs | 97 | As is | in stock |
P-580701178 | BLD pharm | In-stock building blocks | 97 | As is | 655 g |
P-871220889 | BOC Sciences | All products | N/A | As is | by resynthesis (? - ? days) |
P-868591841 | Combi-Blocks | Building Block in stock | 96 | As is | in stock |
P-580406687 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-901369548 | FluoroChem | In Stock BB | N/A | As is | 25 g |
P-524167832 | Key Organics | Building Blocks | 98 | As is | 25 g |
P-579622334 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
P-856041348 | LaboTest | Building Blocks | 90 | As is | unavailable |
P-31267992 | LaboTest | Screening Collection | 90 | As is | unavailable |
P-580487962 | Manchester Organics | Compounds on demand | 97 | As is | by synthesis |
P-852458743 | Matrix Scientific | All | N/A | As is | in stock |
P-854731865 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
P-500407804 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
P-885535946 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-596791244 | Synthonix | In-stock Building Blocks | 97 | As is | 11.795 kg |
P-22793033 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
P-502367751 | TimTec | Building Block Collection | 90 | As is | in stock |
P-615395266 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 232.230 |
logP | 0.2919 |
H-bond acceptors | 6 |
H-bond donors | 0 |
Rotatable bonds | 9 |
PSA | 78.9 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 54.039 |
Atoms | 32 |
Rings | 0 |
Heavy atoms | 16 |
Hydrogen atoms | 16 |
Heteroatoms | 6 |
N/O atoms | 6 |
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 |