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P-3240034

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Name File
SDF P-3240034.sdf
SMILES P-3240034.smiles
Standard InChI P-3240034.inchi
InChIKey P-3240034.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-3240034 VITAS M CHEMICAL LIMITED Collections of Fragments for Fragment-based Drug Discovery 90 1.116 g
Property Value
Components 1
Mass 104.109
logP 0.95328
H-bond acceptors 2
H-bond donors 0
Rotatable bonds 0
PSA 36.68
RO5 violations 0
RO3 violations 0
Refractivity 28.952
Atoms 12
Rings 1
Heavy atoms 8
Hydrogen atoms 4
Heteroatoms 2
N/O atoms 2
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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