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P-3249030

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Name File
SDF P-3249030.sdf
SMILES P-3249030.smiles
Standard InChI P-3249030.inchi
InChIKey P-3249030.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-3249030 VITAS M CHEMICAL LIMITED Collections of Fragments for Fragment-based Drug Discovery 90 unavailable
Property Value
Components 1
Mass 183.251
logP -0.61422
H-bond acceptors 4
H-bond donors 1
Rotatable bonds 4
PSA 50.5
RO5 violations 0
RO3 violations 2
Refractivity 57.7958
Atoms 30
Rings 1
Heavy atoms 13
Hydrogen atoms 17
Heteroatoms 4
N/O atoms 4
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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