MCULE-4624168689
- 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 | 286 USD | 95 | 27 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-4624168689.sdf |
SMILES | MCULE-4624168689.smiles |
Standard InChI | MCULE-4624168689.inchi |
InChIKey | MCULE-4624168689.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-852071073 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
P-890141566 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-615723420 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-851757146 | AmBeed | On request | N/A | As is | by synthesis |
P-591177135 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-454412338 | Key Organics | Building Blocks | 95 | As is | 6 mg |
P-18812755 | Key Organics | Screening Compounds and Fragments | 95 | As is | 6 mg |
P-852416010 | Matrix Scientific | All | N/A | As is | in stock |
P-502398285 | TimTec | Building Block Collection | 90 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 199.632 |
logP | 1.6432 |
H-bond acceptors | 3 |
H-bond donors | 2 |
Rotatable bonds | 1 |
PSA | 41.49 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 54.0395 |
Atoms | 23 |
Rings | 2 |
Heavy atoms | 13 |
Hydrogen atoms | 10 |
Heteroatoms | 4 |
N/O atoms | 3 |
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 |