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  1. InChIKey:
  2. SMILES:
  3. Formula:
Amount Price  Help
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1 mg 105 USD 90 17 working days Get Quote
5 mg 105 USD 90 17 working days Get Quote
10 mg 158 USD 90 17 working days Get Quote
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Name File
SDF P-578258213.sdf
SMILES P-578258213.smiles
Standard InChI P-578258213.inchi
InChIKey P-578258213.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-578258213 Alinda Stock Screening Compounds 90 in stock December 1, 2018
Property Value
Components 1
Mass 430.455
logP 2.5212
H-bond acceptors 8
H-bond donors 1
Rotatable bonds 8
PSA 95.22
RO5 violations 0
RO3 violations 4
Refractivity 122.4067
Atoms 54
Rings 4
Heavy atoms 32
Hydrogen atoms 22
Heteroatoms 8
N/O atoms 8
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