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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

2-isopropylnaphthalene

C13H14

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Entity Type
Ingredients
Relation Groups
2
Relation Preview
6

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
2-isopropylnaphthalene
Molecular Formula
C13H14
Molecular Weight
No data
Canonical SMILES
CC(C)C1=CC2=CC=CC=C2C=C1
Isomeric SMILES
CC(C)C1=CC2=CC=CC=C2C=C1
InChI
InChI=1S/C13H14/c1-10(2)12-8-7-11-5-3-4-6-13(11)9-12/h3-10H,1-2H3
Oral Bioavailability
31.854
Drug Likeness
0.607
DL Score
No data
Caco-2 Permeability
No data
ALogP
No data
Bioavailability Score
No data

Identifiers

InChI Key
No data
PubChem CID
No data

Description and Extensions

Toxicity Information
No data
Related

Related Entities

Direct relations and traceable candidates grouped by relation type.

Source HerbsActive Targets

Active Targets

ingredient target5 Targets
GraphMore Targets
02
PTGS1
prostaglandin-endoperoxide synthase 1
prostaglandin-endoperoxide synthase 1
DetailsGraph
03
PTGS2
prostaglandin-endoperoxide synthase 2
prostaglandin-endoperoxide synthase 2
DetailsGraph
04
SCN5A
sodium voltage-gated channel alpha subunit 5
sodium voltage-gated channel alpha subunit 5
DetailsGraph