01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 6
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 2-methyl-5-(1-methylethylidene)-cyclo-hexanone
- Molecular Formula
- C10H16O
- Molecular Weight
- No data
- Canonical SMILES
- CC1CCC(=C(C)C)CC1=O
- Isomeric SMILES
- C[C@H]1CCC(=C(C)C)CC1=O
- InChI
- InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h8H,4-6H2,1-3H3/t8-/m0/s1
- Oral Bioavailability
- 48.345
- Drug Likeness
- 0.488
- 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.