Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.83	2.89	-11.21	1	2	37	136.15	2	↓ MOL2 SDF SMILES Flexibase
Ref Reference (pH 7)	0.95	3.09	-6.81	1	2	37	136.15	2	↓ MOL2 SDF SMILES Flexibase
Ref Reference (pH 7)	0.95	3.1	-6.95	1	2	37	136.15	2	↓ MOL2 SDF SMILES Flexibase

Note Type	Comments	Provided By
BP	126 / 12	TCI
Mp [°C]	83 - 88	Acros Organics
MP	86 - 89	Enamine Building Blocks
Melting_Point	86-88?	Alfa-Aesar
Melting_Point	86-88°	Alfa-Aesar
M.P	86-89 °C	Indofine
MP	86...89	Enamine Building Blocks
MP	88	TCI
purity	9.500000000000000e+001	Enamine Building Blocks Enamine Building Blocks
Purity	97%	Fluorochem
Purity	98%	APIChem
H phrase	H335: May cause respiratory irritation	Acros Organics
H phrase	H335: May cause respiratory irritation; H315: Causes skin irritation; H319: Causes serious eye irritation	Acros Organics
P phrase	P261: Avoid breathing dust/fume/gas/mist/vapors/spray	Acros Organics
P phrase	P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water	Acros Organics
R phrase	R36/37/38: Irritating to eyes, respiratory system and skin.	Acros Organics
S phrase	S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.	Acros Organics
S phrase	S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection.	Acros Organics
Target	Toll-like receptor 2(O60603)	Herbal Ingredients Targets
Hazard	XI: Irritant	Acros Organics