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)	3.31	6.75	-56.11	0	6	-1	81	400.933	7	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.24	7.03	-20.69	1	6	0	83	401.941	6	↓ MOL2 SDF SMILES Flexibase

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
DHB1-1-E	Estradiol 17-beta-dehydrogenase 1 (cluster #1 Of 1), Eukaryotic	Eukaryotes	52	0.41	Binding ≤ 10μM
DHB2-1-E	Estradiol 17-beta-dehydrogenase 2 (cluster #1 Of 2), Eukaryotic	Eukaryotes	284	0.37	Binding ≤ 10μM
DHI1-1-E	11-beta-hydroxysteroid Dehydrogenase 1 (cluster #1 Of 3), Eukaryotic	Eukaryotes	284	0.37	Binding ≤ 10μM

ChEMBL Target Annotations
Uniprot	Swissprot	Description	Affinity (nM)	LE (kcal/mol/atom)	Type
DHI1_MOUSE	P50172	11-beta-hydroxysteroid Dehydrogenase 1, Mouse	284	0.37	Binding ≤ 1μM
DHI1_HUMAN	P28845	11-beta-hydroxysteroid Dehydrogenase 1, Human	28.4	0.42	Binding ≤ 1μM
DHB1_HUMAN	P14061	Estradiol 17-beta-dehydrogenase 1, Human	52	0.41	Binding ≤ 1μM
DHB2_HUMAN	P37059	Estradiol 17-beta-dehydrogenase 2, Human	284	0.37	Binding ≤ 1μM
DHI1_HUMAN	P28845	11-beta-hydroxysteroid Dehydrogenase 1, Human	1500	0.33	Binding ≤ 10μM
DHI1_MOUSE	P50172	11-beta-hydroxysteroid Dehydrogenase 1, Mouse	284	0.37	Binding ≤ 10μM
DHB1_HUMAN	P14061	Estradiol 17-beta-dehydrogenase 1, Human	52	0.41	Binding ≤ 10μM
DHB2_HUMAN	P37059	Estradiol 17-beta-dehydrogenase 2, Human	284	0.37	Binding ≤ 10μM

Description	Species
Estrogen biosynthesis	Homo sapiens (DHB1_HUMAN)
Glucocorticoid biosynthesis	Mus musculus (DHI1_MOUSE) Homo sapiens (DHI1_HUMAN)
The canonical retinoid cycle in rods (twilight vision)	Homo sapiens (DHB1_HUMAN)