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)	2.77	4.67	-7.25	1	2	0	29	157.257	6	↓ MOL2 SDF SMILES Flexibase
Ref Reference (pH 7)	2.82	2.97	-36.63	2	2	1	34	158.265	6	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	2.82	1.33	-6.49	1	2	0	33	157.257	6	↓ MOL2 SDF SMILES Flexibase

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
ADH1A-3-E	Alcohol Dehydrogenase Alpha Chain (cluster #3 Of 3), Eukaryotic	Eukaryotes	7000	0.66	Binding ≤ 10μM
ADH1B-2-E	Alcohol Dehydrogenase Beta Chain (cluster #2 Of 3), Eukaryotic	Eukaryotes	1700	0.73	Binding ≤ 10μM
ADH1E-1-E	Alcohol Dehydrogenase E Chain (cluster #1 Of 1), Eukaryotic	Eukaryotes	5400	0.67	Binding ≤ 10μM
ADH1G-2-E	Alcohol Dehydrogenase Gamma Chain (cluster #2 Of 3), Eukaryotic	Eukaryotes	410	0.81	Binding ≤ 10μM
ADH1S-1-E	Alcohol Dehydrogenase S Chain (cluster #1 Of 1), Eukaryotic	Eukaryotes	5400	0.67	Binding ≤ 10μM

ChEMBL Target Annotations
Uniprot	Swissprot	Description	Affinity (nM)	LE (kcal/mol/atom)	Type
ADH1G_HUMAN	P00326	Alcohol Dehydrogenase Gamma Chain, Human	410	0.81	Binding ≤ 1μM
ADH1A_HUMAN	P07327	Alcohol Dehydrogenase Alpha Chain, Human	7000	0.66	Binding ≤ 10μM
ADH1B_HUMAN	P00325	Alcohol Dehydrogenase Beta Chain, Human	1700	0.73	Binding ≤ 10μM
ADH1E_HORSE	P00327	Alcohol Dehydrogenase E Chain, Horse	5400	0.67	Binding ≤ 10μM
ADH1G_HUMAN	P00326	Alcohol Dehydrogenase Gamma Chain, Human	410	0.81	Binding ≤ 10μM
ADH1S_HORSE	P00328	Alcohol Dehydrogenase S Chain, Horse	5400	0.67	Binding ≤ 10μM