MCULE-1946694631
- 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 | 70 USD | 90 | 22 working days | Get Quote |
5 mg | 102 USD | 90 | 22 working days | Get Quote |
10 mg | 140 USD | 90 | 22 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-1946694631.sdf |
SMILES | MCULE-1946694631.smiles |
Standard InChI | MCULE-1946694631.inchi |
InChIKey | MCULE-1946694631.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886280100 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-596433012 | Asinex | General screening catalog | 90 | As is | 21 mg |
P-5593128 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 20 mg |
P-14197268 | Life Chemicals | Screening Compounds | 90 | As is | in stock |
P-873068748 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
Property | Value |
---|---|
Components | 1 |
Mass | 241.288 |
logP | 2.26448 |
H-bond acceptors | 4 |
H-bond donors | 1 |
Rotatable bonds | 4 |
PSA | 61.84 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 69.3818 |
Atoms | 33 |
Rings | 2 |
Heavy atoms | 18 |
Hydrogen atoms | 15 |
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 | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |