MCULE-8753585774-0
- 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.
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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 | 33 USD | 90 | 19 working days | Get Quote |
5 mg | 50 USD | 90 | 19 working days | Get Quote |
10 mg | 63 USD | 90 | 19 working days | Get Quote |
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Name | File |
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SDF | MCULE-8753585774-0.sdf |
SMILES | MCULE-8753585774-0.smiles |
Standard InChI | MCULE-8753585774-0.inchi |
InChIKey | MCULE-8753585774-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-4880859 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 50 mg |
P-3590785 | ChemDiv | Discovery Chemistry Library | 90 | As is | 5 mg |
P-502726319 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-503372560 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
P-12285587 | Otava | In-House Stock Library | 90 | As is | 85 mg |
P-19765126 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-33858500 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
P-2744944 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 52 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 394.270 |
logP | 5.698 |
H-bond acceptors | 4 |
H-bond donors | 0 |
Rotatable bonds | 4 |
PSA | 71.91 |
RO5 violations | 1 |
RO3 violations | 5 |
Refractivity | 105.588 |
Atoms | 38 |
Rings | 3 |
Heavy atoms | 25 |
Hydrogen atoms | 13 |
Heteroatoms | 7 |
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 | 1 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 1 |
Undefined stereo double bonds | 0 |