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P-503102104

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Name File
SDF P-503102104.sdf
SMILES P-503102104.smiles
Standard InChI P-503102104.inchi
InChIKey P-503102104.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-503102104 Innovapharm Virtual Screening Compounds 90 by synthesis
Property Value
Components 1
Mass 373.922
logP 5.8177
H-bond acceptors 2
H-bond donors 0
Rotatable bonds 2
PSA 77.7
RO5 violations 1
RO3 violations 3
Refractivity 111.22
Atoms 40
Rings 3
Heavy atoms 24
Hydrogen atoms 16
Heteroatoms 5
N/O atoms 2
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 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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