01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 15
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Penniclavin
- Molecular Formula
- C16H18N2O2
- Molecular Weight
- No data
- Canonical SMILES
- CN1CC(C=C2C1CC3=CNC4=CC=CC2=C34)(CO)O
- Isomeric SMILES
- CN1C[C@@](C=C2[C@H]1CC3=CNC4=CC=CC2=C34)(CO)O
- InChI
- InChI=1S/C16H18N2O2/c1-18-8-16(20,9-19)6-12-11-3-2-4-13-15(11)10(7-17-13)5-14(12)18/h2-4,6-7,14,17,19-20H,5,8-9H2,1H3/t14-,16+/m1/s1
- Oral Bioavailability
- 48.155
- Drug Likeness
- 0.728
- 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.
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02
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