MCULE-1196784946
- 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.
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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.
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1 mg | 10 USD | 98 | 16 working days | Get Quote |
5 mg | 22 USD | 98 | 20 working days | Get Quote |
10 mg | 30 USD | 98 | 20 working days | Get Quote |
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Name | File |
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SDF | MCULE-1196784946.sdf |
SMILES | MCULE-1196784946.smiles |
Standard InChI | MCULE-1196784946.inchi |
InChIKey | MCULE-1196784946.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867537690 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875692720 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869235582 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-606900023 | AmBeed | In stock | N/A | As is | in stock |
P-596936853 | Angene | Building Blocks in stock | 98 | As is | 2 g |
P-864150050 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-675215881 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-888657407 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
P-869162013 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
P-868494002 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 616.478 |
logP | 7.34068 |
H-bond acceptors | 7 |
H-bond donors | 3 |
Rotatable bonds | 9 |
PSA | 111.45 |
RO5 violations | 2 |
RO3 violations | 5 |
Refractivity | 160.3537 |
Atoms | 71 |
Rings | 4 |
Heavy atoms | 42 |
Hydrogen atoms | 29 |
Heteroatoms | 11 |
N/O atoms | 7 |
Inorganic atoms | 0 |
Halogen atoms | 4 |
Chiral centers | 4 |
R/S chiral centers | 4 |
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 |