MCULE-4463620913
- 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 | 36 USD | 90 | 11 working days | Get Quote |
5 mg | 64 USD | 90 | 22 working days | Get Quote |
10 mg | 85 USD | 90 | 22 working days | Get Quote |
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Name | File |
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SDF | MCULE-4463620913.sdf |
SMILES | MCULE-4463620913.smiles |
Standard InChI | MCULE-4463620913.inchi |
InChIKey | MCULE-4463620913.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-4161088 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 50 mg |
P-4858254 | ChemDiv | Discovery Chemistry Library | 90 | As is | 12 mg |
P-34750564 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
P-502446139 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
P-503882454 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
P-35276422 | Maybridge | Screening Collection | 90 | As is | 884 g |
P-424437056 | Otava | In-House Stock Library | 90 | As is | 2 g |
P-617711696 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 2 g |
P-24073503 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-502430577 | TimTec | Building Block Collection | 90 | As is | in stock |
P-22452599 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 212 mg |
P-611594625 | Toronto Research | In stock | 90 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 202.209 |
logP | 1.78778 |
H-bond acceptors | 4 |
H-bond donors | 1 |
Rotatable bonds | 3 |
PSA | 76.11 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 55.2954 |
Atoms | 25 |
Rings | 1 |
Heavy atoms | 15 |
Hydrogen atoms | 10 |
Heteroatoms | 4 |
N/O atoms | 4 |
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 | 1 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 1 |
Undefined stereo double bonds | 0 |