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P-890849562

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Name File
SDF P-890849562.sdf
SMILES P-890849562.smiles
Standard InChI P-890849562.inchi
InChIKey P-890849562.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-890849562 Innovapharm Building Blocks 95 in stock
Property Value
Components 2
Mass 541.904
logP 7.0858
H-bond acceptors 10
H-bond donors 8
Rotatable bonds 15
PSA 172.58
RO5 violations 3
RO3 violations 6
Refractivity 150.392
Atoms 66
Rings 2
Heavy atoms 35
Hydrogen atoms 31
Heteroatoms 13
N/O atoms 10
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 4
Cis/trans stereo double bonds 2
Unknown stereo double bonds 2
Undefined stereo double bonds 0
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