MCULE-7975345755
- 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 | 33 USD | 90 | 19 working days | Get Quote |
5 mg | 35 USD | 95 | 14 working days | Get Quote |
10 mg | 41 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-7975345755.sdf |
SMILES | MCULE-7975345755.smiles |
Standard InChI | MCULE-7975345755.inchi |
InChIKey | MCULE-7975345755.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-852179199 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
P-889949613 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
P-436452373 | Alinda | Building Blocks | 95 | As is | 6 g |
P-851537298 | AmBeed | On request | N/A | As is | by synthesis |
P-595588502 | Asinex | General screening catalog | 90 | As is | 1000 mg |
P-596482274 | Asinex | General bb catalog | 90 | As is | 1000 mg |
P-590794916 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
P-454615829 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-3320784 | ChemDiv | Discovery Chemistry Library | 90 | As is | 17 mg |
P-887195858 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-34742560 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
P-852382519 | Matrix Scientific | All | N/A | As is | in stock |
P-895630486 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-23967717 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-22772370 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
P-502349189 | TimTec | Building Block Collection | 90 | As is | in stock |
P-1576987 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 50 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 248.234 |
logP | 1.2487 |
H-bond acceptors | 6 |
H-bond donors | 2 |
Rotatable bonds | 4 |
PSA | 100.7 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 67.3182 |
Atoms | 30 |
Rings | 2 |
Heavy atoms | 18 |
Hydrogen atoms | 12 |
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 |