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P-872932004

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Name File
SDF P-872932004.sdf
SMILES P-872932004.smiles
Standard InChI P-872932004.inchi
InChIKey P-872932004.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-872932004 BLD pharm In-stock building blocks 98 unavailable
Property Value
Components 2
Mass 451.749
logP 8.2098
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 20
PSA 85.81
RO5 violations 1
RO3 violations 5
Refractivity 132.2266
Atoms 83
Rings 0
Heavy atoms 30
Hydrogen atoms 53
Heteroatoms 6
N/O atoms 5
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
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