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  1. InChIKey:
  2. SMILES:
  3. Formula:
Amount Price  Help
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1 mg 90 USD N/A 17 working days Get Quote
5 mg 90 USD N/A 17 working days Get Quote
10 mg 141 USD N/A 17 working days Get Quote
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Name File
SDF P-578231459.sdf
SMILES P-578231459.smiles
Standard InChI P-578231459.inchi
InChIKey P-578231459.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-578231459 Alinda Stock Screening Compounds N/A in stock December 1, 2018
Property Value
Components 1
Mass 436.310
logP 5.038
H-bond acceptors 6
H-bond donors 2
Rotatable bonds 8
PSA 108.56
RO5 violations 1
RO3 violations 5
Refractivity 111.6399
Atoms 43
Rings 3
Heavy atoms 28
Hydrogen atoms 15
Heteroatoms 9
N/O atoms 6
Inorganic atoms 0
Halogen atoms 2
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