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  1. InChIKey:
  2. SMILES:
  3. Formula:
Amount Price  Help
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Purity (%) Delivery time  Help
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1 mg 115 USD 90 9 working days Get Quote
5 mg 115 USD 90 9 working days Get Quote
10 mg 115 USD 90 9 working days Get Quote
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Name File
SDF P-31211342.sdf
SMILES P-31211342.smiles
Standard InChI P-31211342.inchi
InChIKey P-31211342.txt
mcule product ID Supplier Catalog Purity (%) Product matching Availability Updated
P-31211342 LaboTest Screening Collection 90 in stock February 5, 2014
Property Value
Components 2
Mass 206.174
logP 0.0001
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 2
PSA 81.59
RO5 violations 0
RO3 violations 2
Refractivity 51.9532
Atoms 25
Rings 1
Heavy atoms 14
Hydrogen atoms 11
Heteroatoms 6
N/O atoms 5
Inorganic atoms 1
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