01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 16
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Nicotine
- Molecular Formula
- C10H14N2
- Molecular Weight
- No data
- Canonical SMILES
- CN1CCCC1C2=CN=CC=C2
- Isomeric SMILES
- CN1CCC[C@H]1C2=CN=CC=C2
- InChI
- InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1
- Oral Bioavailability
- 77.668
- Drug Likeness
- 0.626
- 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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Direct relations and traceable candidates grouped by relation type.
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