General Information of the Compound
Compound ID
CP0014398
Compound Name
2-Hydroxybenzoate, I
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Synonyms
Domerine
2 Hydroxybenzoic Acid
2-Carboxyphenol
2-Hydroxybenzenecarboxylic acid
2-Hydroxybenzoic acid
2-hydroxy(1-14c)benzoic acid
69-72-7
ALPHA/BETA HYDROXY ACIDS (SALICYLIC ACID) (SEE ALPHA/BETA HYDROXY ACIDS)
ATA fraction 10, ammonium salt
Acid, 2-Hydroxybenzoic
Acid, Salicylic
Acid, o-Hydroxybenzoic
Acid, ortho-Hydroxybenzoic
Acido o-idrossibenzoico
Acido o-idrossibenzoico [Italian]
Acido salicilico
Acido salicilico [Italian]
Acidum salicylicum
Advanced pain relief callus removers
Advanced pain relief corn removers
Akurza Cream
Akurza Lotion
Alpha/Beta Hydroxy Acids (Glycolic Acid, Salicylic Acid)
BENZOIC ACID,2-HYDROXY SALICYLIC ACID
Benzoic acid, 2-hydroxy-
Benzoic acid, 2-hydroxy-(9CI)
CMC_13852
Clear away wart remover
DHS Sal Shampoo
Dr Scholl's callus removers
Dr Scholl's corn removers
Dr Scholl's wart remover kit
DuoPlant Gel
Duofil wart
Duofil wart remover
Duofilm
Duoplant
E9A559BE-383B-4F83-BC02-3031D03D558A
Freezone
Hydrisalic Gel
Ionil
Ionil plus
Ionil-Plus
K 537
Keralyt
Kyselina 2-hydroxybenzoova
Kyselina 2-hydroxybenzoova [Czech]
Kyselina salicylova
Kyselina salicylova [Czech]
Mediplast pads
O Hydroxybenzoic Acid
O-Carboxyphenol
O-hydroxybenzoic acid
Occlusal
Ortho Hydroxybenzoic Acid
Ortho-Hydroxybenzoic Acid
Orthohydroxybenzoic acid
P&S Shampoo
Phenol derivative, 7
Phenol-2-carboxylic acid
Propa pH Peel-Off Acne Mask
Psoriacid-S-stift
Retarder SAX
Retarder W
Rutranex
SALICYLATE
SALICYLIC ACID (SEE ALSO ALPHA HYDROXY ACIDS)
SALICYLIC ACID, ACS
SAX
Salex Cream
Salex Lotion
Salicyclic acid
Salicylate
Salicylic acid
Salicylic acid & Sulfur Soap
Salicylic acid (6CI,8CI)
Salicylic acid (JP15/USP)
Salicylic acid (TN)
Salicylic acid [USAN:JAN]
Salicylic acid collodion
Salicylic acid soap
Salicylic acid, tech
Salicylic acid-ring-UL-14C
Saligel
Salonil
Sebucare
Sebulex
Stri-Dex
Trans-Ver-Sal
Verrugon
o-Carboxyphenol
o-hydroxybenzoic acid
salicylate
salicylic acid
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Structure
Formula
C7H6O3
Molecular Weight
138.122
Canonical SMILES
OC(=O)c1ccccc1O
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InChI
InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)
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InChIKey
YGSDEFSMJLZEOE-UHFFFAOYSA-N
CAS
7681-06-3
8052-31-1
69-72-7
Physicochemical Property
logP
1.0904
Rotatable Bonds
1
Heavy Atom Count
10
Polar Areas
57.53
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Complexity
10

"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: 338
SID: 14747739
ChEMBL ID
CHEMBL424
DrugBank ID
DB00936
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: PT06109, Geminin
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000015 SW480 Homo sapiens (Human)  1
1
Potency ~ 1995.3 nM
   TI
   LI
   LO
   TS
Protein ID: PT06206, Solute carrier family 22 member 7
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000009 LLC-PK1 Sus scrofa (Pig)  1
1
Km = 81200 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( Salicyclic acid )
Drug Name Salicyclic acid
Indication
Seborrhoeic dermatitis
Approved
Target(s)
Carbonic anhydrase VI (CA-VI)
Inhibitor
Carbonic anhydrase XII (CA-XII)
Inhibitor
Carbonic anhydrase II (CA-II)
Inhibitor
Carbonic anhydrase IV (CA-IV)
Inhibitor
Carbonic anhydrase I (CA-I)
Inhibitor
Prostaglandin G/H synthase 1 (COX-1)
Inhibitor