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P-502485803

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Name File
SDF P-502485803.sdf
SMILES P-502485803.smiles
Standard InChI P-502485803.inchi
InChIKey P-502485803.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502485803 Innovapharm Virtual Building Blocks 95 by synthesis
Property Value
Components 1
Mass 288.751
logP 3.1933
H-bond acceptors 5
H-bond donors 2
Rotatable bonds 4
PSA 83.65
RO5 violations 0
RO3 violations 4
Refractivity 70.2264
Atoms 31
Rings 2
Heavy atoms 18
Hydrogen atoms 13
Heteroatoms 7
N/O atoms 5
Inorganic atoms 0
Halogen atoms 1
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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