P-888628320
- 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 | 53 USD | 95 | 9 working days | Get Quote |
5 mg | 53 USD | 95 | 9 working days | Get Quote |
10 mg | 53 USD | 95 | 9 working days | Get Quote |
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Name | File |
---|---|
SDF | P-888628320.sdf |
SMILES | P-888628320.smiles |
Standard InChI | P-888628320.inchi |
InChIKey | P-888628320.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-888628320 | TargetMol | Screening Compounds - stock amount | 95 | 203 mg |
Property | Value |
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Components | 1 |
Mass | 232.278 |
logP | 2.2632 |
H-bond acceptors | 4 |
H-bond donors | 2 |
Rotatable bonds | 2 |
PSA | 72.19 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 69.5401 |
Atoms | 33 |
Rings | 2 |
Heavy atoms | 17 |
Hydrogen atoms | 16 |
Heteroatoms | 4 |
N/O atoms | 4 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
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 |