MCULE-3646516179
- 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 | 69 USD | 95 | 10 working days | Get Quote |
5 mg | 85 USD | 95 | 10 working days | Get Quote |
10 mg | 117 USD | 95 | 10 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-3646516179.sdf |
SMILES | MCULE-3646516179.smiles |
Standard InChI | MCULE-3646516179.inchi |
InChIKey | MCULE-3646516179.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-852124541 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
P-890167841 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-851686396 | AmBeed | On request | N/A | As is | by synthesis |
P-591002579 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-454379712 | Key Organics | Building Blocks | 95 | As is | 41.672 g |
P-18722581 | Key Organics | Screening Compounds and Fragments | 95 | As is | 41.672 g |
P-852413523 | Matrix Scientific | All | N/A | As is | in stock |
P-502405166 | TimTec | Building Block Collection | 90 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 236.267 |
logP | 0.6151 |
H-bond acceptors | 5 |
H-bond donors | 3 |
Rotatable bonds | 7 |
PSA | 78.43 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 62.9887 |
Atoms | 33 |
Rings | 1 |
Heavy atoms | 17 |
Hydrogen atoms | 16 |
Heteroatoms | 5 |
N/O atoms | 5 |
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 | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |