MCULE-7918865270-0
- 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 | 13 USD | 95 | 11 working days | Get Quote |
5 mg | 13 USD | 95 | 11 working days | Get Quote |
10 mg | 13 USD | 95 | 11 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-7918865270-0.sdf |
SMILES | MCULE-7918865270-0.smiles |
Standard InChI | MCULE-7918865270-0.inchi |
InChIKey | MCULE-7918865270-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-505390917 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-851932456 | AmBeed | In stock | N/A | As is | in stock |
P-489171037 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-895929055 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-896035307 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-617430959 | BLD pharm | In-stock building blocks | 95 | As is | 5 g |
P-868612727 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
P-870655043 | Glentham Life Sciences | Compounds typically in stock | 98 | As is | in stock |
P-488550646 | InterBioScreen | Building Blocks | 90 | As is | in stock |
P-524165036 | Key Organics | Building Blocks | 98 | As is | 25 g |
P-855992782 | Key Organics | Screening Compounds and Fragments | 98 | As is | 100 mg |
P-31161118 | LaboTest | Screening Collection | 90 | As is | unavailable |
P-856041340 | LaboTest | Building Blocks | 90 | As is | unavailable |
P-860789215 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
P-895271204 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-454368962 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
P-424905017 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-885523941 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-23354342 | Specs | Screening Compounds | 90 | As is | 15.991 g |
P-502333032 | TimTec | Building Block Collection | 90 | As is | in stock |
P-611361394 | Toronto Research | In stock | 90 | As is | in stock |
P-3026375 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.498 g |
P-3228249 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.498 g |
P-893995542 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 208.980 |
logP | 1.155 |
H-bond acceptors | 4 |
H-bond donors | 2 |
Rotatable bonds | 0 |
PSA | 74.6 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 41.0296 |
Atoms | 14 |
Rings | 1 |
Heavy atoms | 12 |
Hydrogen atoms | 2 |
Heteroatoms | 6 |
N/O atoms | 4 |
Inorganic atoms | 0 |
Halogen atoms | 2 |
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 |