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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

Wln: scn2r

C9H9NS

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Entity Type
Ingredients
Relation Groups
2
Relation Preview
12

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Wln: scn2r
Molecular Formula
C9H9NS
Molecular Weight
No data
Canonical SMILES
C1=CC=C(C=C1)CCN=C=S
Isomeric SMILES
C1=CC=C(C=C1)CCN=C=S
InChI
InChI=1S/C9H9NS/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5H,6-7H2
Oral Bioavailability
53.701
Drug Likeness
0.492
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
01
ABCC1
ATP binding cassette subfamily C member 1
ATP binding cassette subfamily C member 1
DetailsGraph
02
ABCC2
ATP binding cassette subfamily C member 2
ATP binding cassette subfamily C member 2
DetailsGraph
05
CYP2A13
cytochrome P450 family 2 subfamily A member 13
cytochrome P450 family 2 subfamily A member 13
DetailsGraph
06
CYP2A6
cytochrome P450 family 2 subfamily A member 6
cytochrome P450 family 2 subfamily A member 6
DetailsGraph
07
CYP2E1
cytochrome P450 family 2 subfamily E member 1
cytochrome P450 family 2 subfamily E member 1
DetailsGraph