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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

Pyrene

C16H10

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Entity Type
Ingredients
Relation Groups
2
Relation Preview
16

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Pyrene
Molecular Formula
C16H10
Molecular Weight
No data
Canonical SMILES
C1=CC2=C3C(=C1)C=CC4=CC=CC(=C43)C=C2
Isomeric SMILES
C1=CC2=C3C(=C1)C=CC4=CC=CC(=C43)C=C2
InChI
InChI=1S/C16H10/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-10H
Oral Bioavailability
25.047
Drug Likeness
0.366
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 target8 Targets
GraphMore Targets
02
ALDH1A1
aldehyde dehydrogenase 1 family member A1
aldehyde dehydrogenase 1 family member A1
DetailsGraph
04
CXADR
CXADR Ig-like cell adhesion molecule
CXADR Ig-like cell adhesion molecule
DetailsGraph
06
CYP1A1
cytochrome P450 family 1 subfamily A member 1
cytochrome P450 family 1 subfamily A member 1
DetailsGraph
07
CYP1A2
cytochrome P450 family 1 subfamily A member 2
cytochrome P450 family 1 subfamily A member 2
DetailsGraph
08
CYP1B1
cytochrome P450 family 1 subfamily B member 1
cytochrome P450 family 1 subfamily B member 1
DetailsGraph