General Information of the Compound
Compound ID
CP0042733
Compound Name
4-aminobenzene-1-sulfonamide
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Synonyms
1162 F
4-(Bis(2-bromoethyl)amino)benzenesulfonamide
4-Aminobenzene-1-Sulfonamide
4-Aminophenylsulfonamide
4-Sulfamoylaniline
4-[bis(2-bromoethyl)amino]benzenesulfonamide
A-349
AAS
AVC
AVC (TN)
Albexan
Albosal
Ambeside
Aniline-p-sulfonic amide
Antistrept
Aromatic/heteroaromatic sulfonamide 2
Astreptine
Astrocid
BENZENESULFONIC ACID,4-AMINO,AMIDE SULFANILAMIDE
Bactesid
Benzenesulfonamide, 4-(bis(2-bromoethyl)amino)-(9CI)
Collomide
Colsulanyde
Copticide
Deseptyl
Desseptyl
Dipron
Ergaseptine
F 1162
F-1162
Fourneau 1162
Gerison
Gombardol
I.C. 56
Infepan
Lusil
Lysococcine
N(sup 4),N(sup 4)-Bis(2-bromoethyl)sulfanilamide
N(sup4),N(sup4)-Bis(2-bromoethyl)sulfanilamide
N4,N4-Bis(2-bromoethyl)sulfanilamide
Neococcyl
Orgaseptine
P-Aminobenzenesulfonylamide
P-Aminobenzensulfonamide
PABS
Prontalbin
Prontosil I
Prontosil White
Prontylin
Pronzin Album
Proseptal
Proseptine
Pysococcine
Ro13354
Rubiazol A
SAN
Sanamid
Septamide Album
Septanilam
Septolix
Septoplex
Septoplix
Solfanilamide
Solfanilamide [DCIT]
Stopton Album
Stramid
Strepamide
Streptagol
Streptamid
Streptocid
Streptocid (TN)
Streptocid album
Streptocide
Streptocide (VAN)
Streptocide White
Streptocidum
Streptocom
Streptol
Strepton
Streptopan
Streptrocide
Sulfanilamida
Sulfanilamida [INN-Spanish]
Sulfanilamide
Sulfanilamide (INN)
Sulfanilamide Vaginal Cream
Sulfanilamide [INN:DCF]
Sulfanilamide, N4,N4-bis(2-bromoethyl)-(8CI)
Sulfanilamidum
Sulfanilamidum [INN-Latin]
Sulfocidin
Sulphanilamide Extra Pure
Sulphanilamide Gr
Therapol
Tolder
White streptocide
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Structure
Formula
C6H8N2O2S
Molecular Weight
172.209
Canonical SMILES
Nc1ccc(cc1)S(N)(=O)=O
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InChI
InChI=1S/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
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InChIKey
FDDDEECHVMSUSB-UHFFFAOYSA-N
CAS
63-74-1
102489-34-9
12765-80-9
1337-36-6
1337-39-9
24706-25-0
Physicochemical Property
logP
-0.0838
Rotatable Bonds
1
Heavy Atom Count
11
Polar Areas
86.18
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Complexity
11

"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: 5333
SID: 14748191
ChEMBL ID
CHEMBL21
DrugBank ID
DB00259
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 = 364 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 364 nM
Clinical Information about the Compound
Drug 1 ( Sulfanilamide )
Drug Name Sulfanilamide
Indication
Bacterial infection
Approved
Target(s)
Bacterial Dihydropteroate synthetase (Bact folP)
Modulator
Bacterial Dihydropteroate synthetase (Bact folP)
Modulator