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  1. InChIKey:
  2. SMILES:
  3. Formula:
Amount Price  Help
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1 mg 528 USD 95 12 working days Get Quote
5 mg 528 USD 95 12 working days Get Quote
10 mg 528 USD 95 12 working days Get Quote
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Name File
SDF P-579625724.sdf
SMILES P-579625724.smiles
Standard InChI P-579625724.inchi
InChIKey P-579625724.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-579625724 LabSeeker, Inc Stock Collection 95 in stock August 11, 2017
Property Value
Components 1
Mass 414.396
logP 1.4591
H-bond acceptors 13
H-bond donors 2
Rotatable bonds 10
PSA 172.01
RO5 violations 1
RO3 violations 4
Refractivity 93.4609
Atoms 46
Rings 2
Heavy atoms 28
Hydrogen atoms 18
Heteroatoms 14
N/O atoms 13
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