Caulibugulone F
AlkaPlorer ID: AK319106
Synonym: None
IUPAC Name: 5-(2-hydroxyethylamino)-7-methyliminoisoquinolin-8-one
Structure
SMILES: CNC1=C/C(=N\CCO)C2=CC=NC=C2C1=O
InChI: InChI=1S/C12H13N3O2/c1-13-11-6-10(15-4-5-16)8-2-3-14-7-9(8)12(11)17/h2-3,6-7,13,16H,4-5H2,1H3/b15-10+
InChIKey: MUUKBLUCRRGACD-XNTDXEJSSA-N
Reference
NPASS: NPC209362
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Caulibugula | Bugulidae | Cheilostomatida | Gymnolaemata | Bryozoa | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 231.255
TPSA？: 74.58000000000001
MolLogP？: 0.1625999999999999
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| None | NON-PROTEIN TARGET | IC50 | 0.1 | ug.mL-1 | 10.1021/np030378l |