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P-454361561

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  1. InChIKey:
  2. SMILES:
  3. Formula:
Amount Price  Help
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1 mg 66 USD 90 10 working days Get Quote
5 mg 82 USD 90 10 working days Get Quote
10 mg 112 USD 90 10 working days Get Quote
New customers are eligible for a 10% discount if indicated at the time of ordering.
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Name File
SDF P-454361561.sdf
SMILES P-454361561.smiles
Standard InChI P-454361561.inchi
InChIKey P-454361561.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-454361561 Key Organics Screening Compounds and Fragments 90 34 mg
Property Value
Components 1
Mass 175.230
logP 1.6761
H-bond acceptors 3
H-bond donors 2
Rotatable bonds 1
PSA 53.11
RO5 violations 0
RO3 violations 0
Refractivity 56.9831
Atoms 26
Rings 2
Heavy atoms 13
Hydrogen atoms 13
Heteroatoms 3
N/O atoms 3
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
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