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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

Dimethulen

C14H16

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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
Dimethulen
Molecular Formula
C14H16
Molecular Weight
No data
Canonical SMILES
CCC1=CC2=C(C=CC2=C(C=C1)C)C
Isomeric SMILES
CCC1=CC2=C(C=CC2=C(C=C1)C)C
InChI
InChI=1S/C14H16/c1-4-12-7-5-10(2)13-8-6-11(3)14(13)9-12/h5-9H,4H2,1-3H3
Oral Bioavailability
25.351
Drug Likeness
0.629
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
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