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Ingredients
2-[(2r,6s)-6-[(2r)-2-hydroxy-2-phenylethyl]-1-methylpiperidin-2-yl]-1-phenylethanone
C22H27NO2
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 2-[(2r,6s)-6-[(2r)-2-hydroxy-2-phenylethyl]-1-methylpiperidin-2-yl]-1-phenylethanone
- Molecular Formula
- C22H27NO2
- Molecular Weight
- No data
- Canonical SMILES
- CN1C(CCCC1CC(=O)C2=CC=CC=C2)CC(C3=CC=CC=C3)O
- Isomeric SMILES
- CN1[C@@H](CCC[C@@H]1CC(=O)C2=CC=CC=C2)C[C@H](C3=CC=CC=C3)O
- InChI
- InChI=1S/C22H27NO2/c1-23-19(15-21(24)17-9-4-2-5-10-17)13-8-14-20(23)16-22(25)18-11-6-3-7-12-18/h2-7,9-12,19-21,24H,8,13-16H2,1H3/t19-,20+,21+/m0/s1
- Oral Bioavailability
- 45.532
- Drug Likeness
- 0.802
- 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.
Active Targets
ingredient target8 Targets
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KCNH2
potassium voltage-gated channel subfamily H member 2
potassium voltage-gated channel subfamily H member 2
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