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)	2.70	2.29	-12.81	3	5	0	89	427.173	3	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	2.77	0.53	-44.85	2	5	-1	96	426.165	3	↓ MOL2 SDF SMILES Flexibase

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
CAH1-5-E	Carbonic Anhydrase I (cluster #5 Of 12), Eukaryotic	Eukaryotes	1870	0.33	Binding ≤ 10μM
CAH2-6-E	Carbonic Anhydrase II (cluster #6 Of 15), Eukaryotic	Eukaryotes	84	0.41	Binding ≤ 10μM
CAH4-1-E	Carbonic Anhydrase IV (cluster #1 Of 16), Eukaryotic	Eukaryotes	50	0.43	Binding ≤ 10μM
CAH9-1-E	Carbonic Anhydrase IX (cluster #1 Of 11), Eukaryotic	Eukaryotes	5	0.48	Binding ≤ 10μM

ChEMBL Target Annotations
Uniprot	Swissprot	Description	Affinity (nM)	LE (kcal/mol/atom)	Type
CAH2_HUMAN	P00918	Carbonic Anhydrase II, Human	84	0.41	Binding ≤ 1μM
CAH4_BOVIN	Q95323	Carbonic Anhydrase IV, Bovin	50	0.43	Binding ≤ 1μM
CAH9_HUMAN	Q16790	Carbonic Anhydrase IX, Human	4.8	0.49	Binding ≤ 1μM
CAH1_HUMAN	P00915	Carbonic Anhydrase I, Human	1870	0.33	Binding ≤ 10μM
CAH2_HUMAN	P00918	Carbonic Anhydrase II, Human	84	0.41	Binding ≤ 10μM
CAH4_BOVIN	Q95323	Carbonic Anhydrase IV, Bovin	50	0.43	Binding ≤ 10μM
CAH9_HUMAN	Q16790	Carbonic Anhydrase IX, Human	4.8	0.49	Binding ≤ 10μM

Description	Species
Erythrocytes take up carbon dioxide and release oxygen	Bos taurus (CAH4_BOVIN) Homo sapiens (CAH1_HUMAN)
Erythrocytes take up oxygen and release carbon dioxide	Bos taurus (CAH4_BOVIN) Homo sapiens (CAH1_HUMAN)
Regulation of gene expression by Hypoxia-inducible Factor	Homo sapiens (CAH9_HUMAN)
Reversible hydration of carbon dioxide	Bos taurus (CAH4_BOVIN) Homo sapiens (CAH1_HUMAN)