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	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.50	1.11	-5.49	2	2	0	39	173.013	0	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	1.50	1.38	-28.1	3	2	1	40	174.021	0	↓ MOL2 SDF SMILES Flexibase

Note Type	Comments	Provided By
BP	180	TCI
MP	74 - 76	Enamine Building Blocks
MP	74...76	Enamine Building Blocks
Mp [°C]	75 - 79	Acros Organics
Melting_Point	75-79?	Alfa-Aesar
Melting_Point	75-79°	Alfa-Aesar
MP	76-77°	Matrix Scientific
MP	77	TCI
purity	9.500000000000000e+001	Enamine Building Blocks Enamine Building Blocks
Purity	97%	Matrix Scientific
Purity	98%	APIChem
Purity	>97%	Fluorochem
H phrase	H319: Causes serious eye irritation	Acros Organics
H phrase	H319: Causes serious eye irritation; H315: Causes skin irritation; H335: May cause respiratory irritation	Acros Organics
Warnings	IRRITANT	Matrix Scientific
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
Hazard	XI: Irritant	Acros Organics

No pre-computed analogs available. Try a structural similarity search.