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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

Neopentane

C5H12

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Entity Type
Ingredients
Relation Groups
2
Relation Preview
9

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Neopentane
Molecular Formula
C5H12
Molecular Weight
No data
Canonical SMILES
CC(C)(C)C
Isomeric SMILES
CC(C)(C)C
InChI
InChI=1S/C5H12/c1-5(2,3)4/h1-4H3
Oral Bioavailability
54.878
Drug Likeness
0.411
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
ACHE
acetylcholinesterase (Cartwright blood group)
acetylcholinesterase (Cartwright blood group)
DetailsGraph
03
ADH1A
alcohol dehydrogenase 1A (class I), alpha polypeptide
alcohol dehydrogenase 1A (class I), alpha polypeptide
DetailsGraph