Molokaiamine; N3''-(Aminocarbonyl)
AlkaPlorer ID: AK111988
Synonym: Ceratinine C
IUPAC Name: 3-[4-(2-aminoethyl)-2,6-dibromophenoxy]propylurea
Structure
SMILES: NCCC1=CC(Br)=C(OCCCNC(N)=O)C(Br)=C1
InChI: InChI=1S/C12H17Br2N3O2/c13-9-6-8(2-3-15)7-10(14)11(9)19-5-1-4-17-12(16)18/h6-7H,1-5,15H2,(H3,16,17,18)
InChIKey: JRWJKYPFYWXIDU-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pseudoceratina arabica | Pseudoceratina | Pseudoceratinidae | Verongiida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 395.095
TPSA？: 90.37
MolLogP？: 2.1500000000000004
Number of H-Donors: 3
Number of H-Acceptors: 3
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|