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  1. InChIKey:
  2. SMILES:
  3. Formula:
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1 mg 299 USD 90 25 working days Get Quote
5 mg 319 USD 90 25 working days Get Quote
10 mg 342 USD 90 25 working days Get Quote
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Name File
SDF P-92641050.sdf
SMILES P-92641050.smiles
Standard InChI P-92641050.inchi
InChIKey P-92641050.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-92641050 Enamine REAL database 90 by synthesis January 20, 2015
Property Value
Components 1
Mass 230.305
logP 2.8377
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 3
PSA 41.99
RO5 violations 0
RO3 violations 0
Refractivity 68.1297
Atoms 35
Rings 3
Heavy atoms 17
Hydrogen atoms 18
Heteroatoms 3
N/O atoms 3
Inorganic atoms 0
Halogen atoms 0
Chiral centers 3
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 3
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0