MCULE-7182736800
- 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 | 18 USD | 10 | 19 working days | Get Quote |
5 mg | 18 USD | 10 | 19 working days | Get Quote |
10 mg | 18 USD | 10 | 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-9630479900
- Component type: Main
Name | File |
---|---|
SDF | MCULE-7182736800.sdf |
SMILES | MCULE-7182736800.smiles |
Standard InChI | MCULE-7182736800.inchi |
InChIKey | MCULE-7182736800.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867564627 | A2B Chem | Predominantly Building Block in stock | 10 | As is | in stock |
P-505393543 | AK Scientific | Building Blocks | 10 | As is | in stock |
P-869277802 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-517095281 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
P-851940297 | AmBeed | In stock | N/A | As is | in stock |
P-596928710 | Angene | Building Blocks in stock | 90 | As is | 200 g |
P-864157382 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-580302887 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-889117927 | FluoroChem | In Stock BB | 99 | As is | 900 mg |
P-870663006 | Glentham Life Sciences | Compounds maintained in stock | 10 | As is | in stock |
P-868078294 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-588711140 | Key Organics | Building Blocks | 97 | As is | unavailable |
P-885537378 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-872516722 | Ramidus | In stock compounds | 95 | As is | in stock |
P-617403557 | Selleckchem | Product Catalog | N/A | As is | in stock |
P-869177095 | TargetMol | Natural Products | 95 | As is | 4.771 g |
P-33162946 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 3 mg |
P-854957463 | Toronto Research | In stock | 90 | As is | in stock |
P-854979742 | Toronto Research | In stock | 90 | As is | in stock |
P-854979748 | Toronto Research | In stock | 90 | As is | in stock |
P-854979753 | Toronto Research | In stock | 90 | As is | in stock |
P-615409113 | eNovation Chemicals LLC | Building Blocks in stock | 93 | As is | in stock |
P-613846671 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
P-867734725 | AmBeed | On request | N/A | As a main component | by synthesis |
P-868831195 | Angene | Building Blocks in stock | 98 | As a main component | 300 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 304.466 |
logP | 6.2167 |
H-bond acceptors | 2 |
H-bond donors | 1 |
Rotatable bonds | 14 |
PSA | 37.3 |
RO5 violations | 1 |
RO3 violations | 3 |
Refractivity | 98.1298 |
Atoms | 54 |
Rings | 0 |
Heavy atoms | 22 |
Hydrogen atoms | 32 |
Heteroatoms | 2 |
N/O atoms | 2 |
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 | 4 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 4 |
Undefined stereo double bonds | 0 |