Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 2Ingredient: 1Target: 12Links: 14
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 29245
- Core Entity Id
- 35693
- Source Entity Count
- 1
- Preferred Name
- P-dichlorobenzene
- Name En
- Pubchem Id
- 4685
- Smiles Canonical
- C1=CC(=CC=C1Cl)Cl
- Molecular Formula
- C6H4Cl2
- Molecular Weight
- 147.0040
- Inchikey
- OCJBOOLMMGQPQU-UHFFFAOYSA-N
- Inchi
- InChI=1S/C6H4Cl2/c7-5-1-2-6(8)4-3-5/h1-4H
- Isomeric Smiles
- C1=CC(=CC=C1Cl)Cl
- Cas Id
- Ob Score
- Mol Logp
- 2.9934
- Num H Donors
- 0
- Num H Acceptors
- 0
- Num Rotatable Bonds
- 0
- Drug Likeness
- 0.5290
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
P-Dichlorobenzene
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
P-dichlorobenzene
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
P-dichlorobenzene
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
P-dichlorobenzene
Role
preferred
Source
TCMBank
Preferred
Yes
Name
1,4-DICHLOROBENZENE
Role
alias
Source
HERB_v2
Preferred
No
Name
1,4-DICHLOROBENZENE
Role
alias
Source
itcmdb_public
Preferred
No
Name
106-46-7
Role
alias
Source
itcmdb_public
Preferred
No
Name
106-46-7
Role
alias
Source
HERB_v2
Preferred
No
Name
Paracide
Role
alias
Source
HERB_v2
Preferred
No
Name
Paracide
Role
alias
Source
itcmdb_public
Preferred
No
Name
Paradow
Role
alias
Source
HERB_v2
Preferred
No
Name
Paradow
Role
alias
Source
itcmdb_public
Preferred
No
Name
Paramoth
Role
alias
Source
HERB_v2
Preferred
No
Name
Paramoth
Role
alias
Source
itcmdb_public
Preferred
No
Name
Paranuggets
Role
alias
Source
HERB_v2
Preferred
No
Name
Paranuggets
Role
alias
Source
itcmdb_public
Preferred
No
Name
Santochlor
Role
alias
Source
HERB_v2
Preferred
No
Name
Santochlor
Role
alias
Source
itcmdb_public
Preferred
No
Name
para-Dichlorobenzene
Role
alias
Source
itcmdb_public
Preferred
No
Name
paradichlorobenzene
Role
alias
Source
HERB_v2
Preferred
No
Aliases
Additional names normalized into the restored final schema.
1,4-DICHLOROBENZENE106-46-7ParacideParadowParamothParanuggetsSantochlorpara-Dichlorobenzeneparadichlorobenzene
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN039010
Npass
NPC18259
Tcmid
36529
Sym Map
SMIT25932
Pub Chem
4685
Tcmbank
TCMBANKIN016585
Itcmdb Generated
ITX-INGREDIENT-F6F1A77F9B33
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C6H4Cl2/c7-5-1-2-6(8)4-3-5/h1-4H
Mol Wt
147.004
Smiles
C1=CC(=CC=C1Cl)Cl
Mol Log P
2.9934
Version
v2
In Ch Ikey
OCJBOOLMMGQPQU-UHFFFAOYSA-N
Suppress
0
Num Hdonors
0
Drug Likeness
0.529
Num Hacceptors
0
Isomeric Smiles
C1=CC(=CC=C1Cl)Cl
Canonical Smiles
C1=CC(=CC=C1Cl)Cl
Herb Alias Names
1,4-DICHLOROBENZENE106-46-7paradichlorobenzenepara-DichlorobenzeneParacideParamothParanuggetsSantochlorParadow
Molecular Weight
147 g/mol
Molecular Formula
C6H4Cl2
Molecular Formula
C6H4Cl2
Num Rotatable Bonds
0