107019-95-4
AlkaPlorer ID: AK016974
Synonym: '', 'Hymenidin'
IUPAC Name: N-[3-(2-amino-1H-imidazol-5-yl)prop-2-enyl]-4-bromo-1H-pyrrole-2-carboxamide
Structure
SMILES: NC1=NC=C(C=CCNC(=O)C2=CC(Br)=CN2)N1
InChI: InChI=1S/C11H12BrN5O/c12-7-4-9(15-5-7)10(18)14-3-1-2-8-6-16-11(13)17-8/h1-2,4-6,15H,3H2,(H,14,18)(H3,13,16,17)
InChIKey: KHJREOQCERRAME-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Agelas nakamurai | Agelas | Agelasidae | Agelasida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 310.155
TPSA？: 99.58999999999996
MolLogP？: 1.5256999999999998
Number of H-Donors: 4
Number of H-Acceptors: 3
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|