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  1. InChIKey:
  2. SMILES:
  3. Formula:
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1 mg 145 USD 90 16 working days Get Quote
5 mg 145 USD 90 16 working days Get Quote
10 mg 145 USD 90 16 working days Get Quote
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Name File
SDF P-34757063.sdf
SMILES P-34757063.smiles
Standard InChI P-34757063.inchi
InChIKey P-34757063.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-34757063 Crea-Chim HTS compounds 90 in stock August 1, 2014
Property Value
Components 1
Mass 199.272
logP 2.25
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 4
PSA 54.55
RO5 violations 0
RO3 violations 1
Refractivity 52.7877
Atoms 26
Rings 1
Heavy atoms 13
Hydrogen atoms 13
Heteroatoms 4
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 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0