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)	2.49	1.41	-7.7	4	5	0	90	213.244	2	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	2.49	1.89	-34.29	5	5	1	91	214.252	2	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	2.49	3.21	-33.91	5	5	1	91	214.252	2	↓ MOL2 SDF SMILES Flexibase

Note Type	Comments	Provided By
Molecular_Solubility	2.857	Bitter DB
Purity	95%	Fluorochem
Purity	95+%	Matrix Scientific
Therapy	analgesic	SMDC Iconix
Melting_Point	ca 240? dec.	Alfa-Aesar
Melting_Point	ca 240° dec.	Alfa-Aesar
H phrase	H302: Harmful if swallowed; H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation; H351: Suspected of causing cancer if inhaled; H317: May cause an allergic skin reaction	Acros Organics
Warnings	IRRITANT	Matrix Scientific
P phrase	P280: Wear protective gloves/protective clothing/eye protection/face protection; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P304 + P341: IF INHALED: If	Acros Organics
R phrase	R22: Harmful if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin.; R40: Limited evidence of a carcinogenic effect.; R43: May cause sensitisation by skin contact.	Acros Organics
S phrase	S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case of accident or if you feel unwell, seek medical advice immediat	Acros Organics
Purity	USP24	APIChem
Hazard	XN: Harmful	Acros Organics

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