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  1. InChIKey:
  2. SMILES:
  3. Formula:
Amount Price  Help
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Purity (%) Delivery time  Help
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1 mg 141 USD 92 9 working days Get Quote
5 mg 141 USD 92 9 working days Get Quote
10 mg 141 USD 92 9 working days Get Quote
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Name File
SDF P-13885705.sdf
SMILES P-13885705.smiles
Standard InChI P-13885705.inchi
InChIKey P-13885705.txt
mcule product ID Supplier Catalog Purity (%) Product matching Availability Updated
P-13885705 Pharmeks Semi-natural compounds 92 in stock November 2, 2012
Property Value
Components 1
Mass 326.346
logP 2.362
H-bond acceptors 6
H-bond donors 1
Rotatable bonds 5
PSA 73.58
RO5 violations 0
RO3 violations 4
Refractivity 91.566
Atoms 42
Rings 3
Heavy atoms 24
Hydrogen atoms 18
Heteroatoms 6
N/O atoms 6
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