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P-36850

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Name File
SDF P-36850.sdf
SMILES P-36850.smiles
Standard InChI P-36850.inchi
InChIKey P-36850.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-36850 Chemical Block Screening Library 90 9 mg
Property Value
Components 1
Mass 289.754
logP 4.0473
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 5
PSA 38.33
RO5 violations 0
RO3 violations 2
Refractivity 81.7097
Atoms 36
Rings 2
Heavy atoms 20
Hydrogen atoms 16
Heteroatoms 4
N/O atoms 3
Inorganic atoms 0
Halogen atoms 1
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
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