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  1. InChIKey:
  2. SMILES:
  3. Formula:
Amount Price  Help
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1 mg 260 USD 90 9 working days Get Quote
5 mg 260 USD 90 9 working days Get Quote
10 mg 260 USD 90 9 working days Get Quote
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Name File
SDF P-12888832.sdf
SMILES P-12888832.smiles
Standard InChI P-12888832.inchi
InChIKey P-12888832.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-12888832 Specs Screening Compounds 90 150 mg
Property Value
Components 1
Mass 213.317
logP 3.723
H-bond acceptors 1
H-bond donors 1
Rotatable bonds 4
PSA 12.03
RO5 violations 0
RO3 violations 2
Refractivity 73.6777
Atoms 35
Rings 2
Heavy atoms 16
Hydrogen atoms 19
Heteroatoms 1
N/O atoms 1
Inorganic atoms 0
Halogen atoms 0
Chiral centers 2
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 2
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0