MCULE-6728882368
- 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 | 22 working days | Get Quote |
5 mg | 5 USD | 95 | 22 working days | Get Quote |
10 mg | 5 USD | 95 | 22 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-7139324193
- Component type: Unknown
Name | File |
---|---|
SDF | MCULE-6728882368.sdf |
SMILES | MCULE-6728882368.smiles |
Standard InChI | MCULE-6728882368.inchi |
InChIKey | MCULE-6728882368.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867542705 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-875699539 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869189646 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-505388911 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-505388925 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-606861127 | AmBeed | In stock | N/A | As is | in stock |
P-596938722 | Angene | Building Blocks in stock | 98 | As is | 2.30999 kg |
P-864085348 | AstaTech | In Stock BBs | 97 | As is | in stock |
P-864113641 | AstaTech | In Stock BBs | 97 | As is | in stock |
P-868545506 | Axon Medchem | Axon predominantly SC catalog | 99 | As is | in stock |
P-893219556 | Biosynth | In Stock | 95 | As is | in stock |
P-893238765 | Biosynth | In Stock | 95 | As is | in stock |
P-580452685 | CliniSciences S.A.S | All products | 99 | As is | in stock |
P-428630140 | Eximed | In-stock screening compounds | 90 | As is | 8.165 g |
P-492273273 | Eximed | Building Block Catalog | 95 | As is | 8.165 g |
P-505493272 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-488556077 | InterBioScreen | Bioactive compounds | 92 | As is | in stock |
P-488546889 | InterBioScreen | Building Blocks | 90 | As is | in stock |
P-524441578 | Key Organics | Biochemicals | 97 | As is | 477 mg |
P-674817435 | Otava | In-House Stock Library | 90 | As is | 8.165 g |
P-620219078 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 8.165 g |
P-454366665 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
P-500375515 | Pi Chemicals | Virtual Compounds | N/A | As is | by synthesis |
P-505618646 | Ramidus | In stock compounds | 98 | As is | in stock |
P-869162397 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
P-892297510 | TargetMol | In Stock BB | 95 | As is | unavailable |
P-888657762 | TargetMol | Screening Compounds - stock amount | 95 | As is | 200 mg |
P-611445568 | Toronto Research | In stock | 90 | As is | in stock |
P-855363229 | Toronto Research | In stock | 90 | As is | in stock |
P-480978337 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
P-481000711 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
P-524444450 | Key Organics | Biochemicals | 97 | As a component | 5.154 g |
Property | Value |
---|---|
Components | 1 |
Mass | 435.518 |
logP | 4.1617 |
H-bond acceptors | 8 |
H-bond donors | 2 |
Rotatable bonds | 11 |
PSA | 112.07 |
RO5 violations | 0 |
RO3 violations | 5 |
Refractivity | 122.9535 |
Atoms | 61 |
Rings | 3 |
Heavy atoms | 32 |
Hydrogen atoms | 29 |
Heteroatoms | 8 |
N/O atoms | 8 |
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 |