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P-498656051

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Name File
SDF P-498656051.sdf
SMILES P-498656051.smiles
Standard InChI P-498656051.inchi
InChIKey P-498656051.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-498656051 Synthonix In-stock Building Blocks 97 unavailable
Property Value
Components 2
Mass 254.206
logP 2.5903
H-bond acceptors 5
H-bond donors 2
Rotatable bonds 3
PSA 89.35
RO5 violations 0
RO3 violations 2
Refractivity 52.4472
Atoms 30
Rings 1
Heavy atoms 17
Hydrogen atoms 13
Heteroatoms 8
N/O atoms 5
Inorganic atoms 0
Halogen atoms 3
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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