MCULE-5815193562
- 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 | 35 USD | 90 | 19 working days | Get Quote |
5 mg | 52 USD | 90 | 19 working days | Get Quote |
10 mg | 67 USD | 90 | 19 working days | Get Quote |
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Name | File |
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SDF | MCULE-5815193562.sdf |
SMILES | MCULE-5815193562.smiles |
Standard InChI | MCULE-5815193562.inchi |
InChIKey | MCULE-5815193562.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886224309 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-4717684 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 100 mg |
P-5154793 | ChemDiv | Discovery Chemistry Library | 90 | As is | 36 mg |
P-502805104 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-503854054 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
P-14074870 | Life Chemicals | Screening Compounds | 90 | As is | in stock |
P-12275947 | Otava | In-House Stock Library | 90 | As is | 100 mg |
P-19086221 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-33806339 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
P-2583007 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 110 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 330.763 |
logP | 3.2306 |
H-bond acceptors | 5 |
H-bond donors | 1 |
Rotatable bonds | 4 |
PSA | 58.64 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 91.8127 |
Atoms | 38 |
Rings | 3 |
Heavy atoms | 23 |
Hydrogen atoms | 15 |
Heteroatoms | 6 |
N/O atoms | 5 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
Chiral centers | 1 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 1 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |