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MCULE-6647815245-1

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Name	File
SDF	MCULE-6647815245-1.sdf
SMILES	MCULE-6647815245-1.smiles
Standard InChI	MCULE-6647815245-1.inchi
InChIKey	MCULE-6647815245-1.txt

Property	Value
Components	1
Mass	89.027
logP	-2.1791
H-bond acceptors	4
H-bond donors	1
Rotatable bonds	1
PSA	77.43
RO5 violations	0
RO3 violations	2
Refractivity	13.3293
Atoms	7
Rings	0
Heavy atoms	6
Hydrogen atoms	1
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

MCULE-6647815245-1

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