General Information of the Compound
Compound ID
CP0034628
Compound Name
6-ethoxy-1,3-benzothiazole-2-sulfonamide
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Synonyms
Cardrase
2-Benzothiazolesulfonamide, 6-ethoxy-
452-35-7
6-(ethyloxy)-1,3-benzothiazole-2-sulfonamide
6-Ethoxy-1,3-benzothiazole-2-sulfonamide
6-Ethoxy-2-benzothiazolesulfonamide
6-Ethoxy-benzothiazole-2-sulfonic acid amide
6-Ethoxybenzo[d]thiazole-2-sulfonamide
6-Ethoxybenzothiazole-2-sulfonamide
6-Ethoxybenzothiazole-2-sulphonamide
6-Ethoxyzolamide
6-ethoxy-1,3-benzothiazole-2-sulfonamide
AI3-50805
BRN 0212240
C9H10N2O3S2
CHEMBL18
Cardrase
Cardrase (TN)
Diuretic C
EINECS 207-199-5
EZL
Ethamide
Ethoxazolamide
Ethoxyzolamide
Ethoxzolamide
Ethoxzolamide (EZA)
Etoxzolamide
Glaucotensil
HSDB 3268
MLS000028637
Mingoral
NSC 10679
Redupresin
U-4191
UNII-Z52H4811WX
ethoxzolamide
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Structure
Formula
C9H10N2O3S2
Molecular Weight
258.324
Canonical SMILES
CCOc1ccc2nc(sc2c1)S(N)(=O)=O
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InChI
InChI=1S/C9H10N2O3S2/c1-2-14-6-3-4-7-8(5-6)15-9(11-7)16(10,12)13/h3-5H,2H2,1H3,(H2,10,12,13)
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InChIKey
OUZWUKMCLIBBOG-UHFFFAOYSA-N
CAS
452-35-7
Physicochemical Property
logP
1.3424
Rotatable Bonds
3
Heavy Atom Count
16
Polar Areas
82.28
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
5
Complexity
16

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 3295
SID: 15213608
ChEMBL ID
CHEMBL18
DrugBank ID
DB00311
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT00209, Carbonic anhydrase
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
Ki = 39.4 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 39.4 nM
Clinical Information about the Compound
Drug 1 ( Ethoxzolamide )
Drug Name Ethoxzolamide
Indication
Glaucoma/ocular hypertension
Approved
Duodenal ulcer
Withdrawn from market
Target(s)
Carbonic anhydrase II (CA-II)
Inhibitor
Carbonic anhydrase I (CA-I)
Modulator