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MCULE-8851164980

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mcule product ID	Supplier	Catalog	Guaranteed purity (%)	Product matching	Availability
P-892941593	A2B Chem	Predominantly Building Block on demand	N/A	As is	by synthesis
P-893108418	A2B Chem	Predominantly Building Block on demand	N/A	Main component	by synthesis
P-901555308	Biosynth	Synthesis	95	Main component	by synthesis

Property	Value
Components	2
Mass	671.806
logP	3.2197
H-bond acceptors	13
H-bond donors	4
Rotatable bonds	6
PSA	180.96
RO5 violations	2
RO3 violations	6
Refractivity	187.347
Atoms	92
Rings	7
Heavy atoms	47
Hydrogen atoms	45
Heteroatoms	14
N/O atoms	13
Inorganic atoms	0
Halogen atoms	0
Chiral centers	6
R/S chiral centers	0
Unknown chiral centers	0
Undefined chiral centers	6
Stereo double bonds	0
Cis/trans stereo double bonds	0
Unknown stereo double bonds	0
Undefined stereo double bonds	0