Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 10Ingredient: 1Target: 12Links: 22
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 64869
- Core Entity Id
- 111887
- Source Entity Count
- 1
- Preferred Name
- Tolbutamide
- Name En
- Pubchem Id
- 5505
- Smiles Canonical
- CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)C
- Molecular Formula
- C12H18N2O3S
- Molecular Weight
- 270.1000
- Inchikey
- JLRGJRBPOGGCBT-UHFFFAOYSA-N
- Inchi
- InChI=1S/C12H18N2O3S/c1-3-4-9-13-12(15)14-18(16,17)11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3,(H2,13,14,15)
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 2.3000
- Num H Donors
- 2
- Num H Acceptors
- 3
- Num Rotatable Bonds
- 5
- Drug Likeness
- Polar Surface Area
- 83.7000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Tolbutamide
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Tolbutamide
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
tolbutamide
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT27208
Etcm Ingredient
tolbutamide
Itcmdb Generated
ITX-INGREDIENT-39CDD3B40555ITX-INGREDIENT-A330427CF418
Attributes
Merged source attributes and domain-specific metadata.
Type
Blood ingredients
Version
v2
Suppress
0
Molecular Weight
270.100
Molecular Formula
C12H18N2O3S
Fda Maximum Daily Dose (Fdamdd)
0.020
Quantitative Estimate Of Drug Likeness（Qed）
0.801