Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 6Ingredient: 1Target: 6Links: 12
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 1043
- Core Entity Id
- 4353
- Source Entity Count
- 1
- Preferred Name
- 2,5-dimethylpiazine
- Name En
- Pubchem Id
- 31252
- Smiles Canonical
- CC1=CN=C(C=N1)C
- Molecular Formula
- C6H8N2
- Molecular Weight
- 108.1440
- Inchikey
- LCZUOKDVTBMCMX-UHFFFAOYSA-N
- Inchi
- InChI=1S/C6H8N2/c1-5-3-8-6(2)4-7-5/h3-4H,1-2H3
- Isomeric Smiles
- CC1=CN=C(C=N1)C
- Cas Id
- 123-32-0
- Ob Score
- 34.1216
- Mol Logp
- 1.0934
- Num H Donors
- 0
- Num H Acceptors
- 2
- Num Rotatable Bonds
- 0
- Drug Likeness
- 0.4970
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
2,5-Dimethylpiazine
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
2,5-Dimethylpiazine
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
2,5-dimethylpiazine
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
2,5-dimethylpiazine
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
123-32-0
Role
alias
Source
itcmdb_public
Preferred
No
Name
123-32-0
Role
alias
Source
HERB_v2
Preferred
No
Name
2,5-DIMETHYLPYRAZINE
Role
alias
Source
itcmdb_public
Preferred
No
Name
2,5-DIMETHYLPYRAZINE
Role
alias
Source
HERB_v2
Preferred
No
Name
2,5-Dimethyl-1,4-diazine
Role
alias
Source
HERB_v2
Preferred
No
Name
2,5-Dimethyl-1,4-diazine
Role
alias
Source
itcmdb_public
Preferred
No
Name
2,5-Dimethylparadiazine
Role
alias
Source
HERB_v2
Preferred
No
Name
2,5-Dimethylparadiazine
Role
alias
Source
itcmdb_public
Preferred
No
Name
CCRIS 2929
Role
alias
Source
HERB_v2
Preferred
No
Name
CCRIS 2929
Role
alias
Source
itcmdb_public
Preferred
No
Name
FEMA No. 3272
Role
alias
Source
HERB_v2
Preferred
No
Name
FEMA No. 3272
Role
alias
Source
itcmdb_public
Preferred
No
Name
NSC 49139
Role
alias
Source
HERB_v2
Preferred
No
Name
NSC 49139
Role
alias
Source
itcmdb_public
Preferred
No
Name
Pyrazine, 2,5-dimethyl-
Role
alias
Source
HERB_v2
Preferred
No
Name
Pyrazine, 2,5-dimethyl-
Role
alias
Source
itcmdb_public
Preferred
No
Name
2,5-Dimethyl Pyrazine
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
2,5-dimethyl pyrazine
Role
preferred
Source
TCMBank
Preferred
Yes
Aliases
Additional names normalized into the restored final schema.
123-32-02,5-DIMETHYLPYRAZINE2,5-Dimethyl-1,4-diazine2,5-DimethylparadiazineCCRIS 2929FEMA No. 3272NSC 49139Pyrazine, 2,5-dimethyl-2,5-Dimethyl Pyrazine
Cross References
Trusted external identifiers retained for this final record.
Cas
123-32-0
Herb
HBIN004661HBIN004662
Npass
NPC204104
Tcmid
4058641489
Tcmsp
MOL007884
Sym Map
SMIT09241SMIT20533
Pub Chem
31252
Tcmbank
TCMBANKIN060041
Etcm Ingredient
2,5-Dimethylpiazine
Itcmdb Generated
ITX-INGREDIENT-53A867EB5F42ITX-INGREDIENT-07E70937DDE4
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C6H8N2/c1-5-3-8-6(2)4-7-5/h3-4H,1-2H3
Mol Wt
108.144
Cas Id
123-32-0
Smiles
CC1=CN=C(C=N1)C
Mol Log P
1.09344
Version
v1,v2
In Ch Ikey
LCZUOKDVTBMCMX-UHFFFAOYSA-N
Ob Score
34.1216481234.122
Suppress
0
Num Hdonors
0
Drug Likeness
0.497
Num Hacceptors
2
Isomeric Smiles
CC1=CN=C(C=N1)C
Molecule Weight
108.16
Canonical Smiles
CC1=CN=C(C=N1)C
Herb Alias Names
2,5-DIMETHYLPYRAZINE123-32-02,5-Dimethyl pyrazinePyrazine, 2,5-dimethyl-2,5-Dimethyl-1,4-diazineNSC 491392,5-DimethylparadiazineFEMA No. 3272CCRIS 2929
Molecular Weight
108.070
Molecular Weight
108.14 g/mol
Molecular Formula
C6H8N2
Molecular Formula
C6H8N2
Molecular Formula
C6H8N2
Num Rotatable Bonds
0
Fda Maximum Daily Dose (Fdamdd)
0.036
Quantitative Estimate Of Drug Likeness（Qed）
0.497