N1-(2-nitrophenyl)propane-1,3-diamine
AlkaPlorer ID: AK393600
Synonym: None
IUPAC Name: N'-(2-nitrophenyl)propane-1,3-diamine
Structure
SMILES: NCCCNC1=CC=CC=C1[N+](=O)[O-]
InChI: InChI=1S/C9H13N3O2/c10-6-3-7-11-8-4-1-2-5-9(8)12(13)14/h1-2,4-5,11H,3,6-7,10H2
InChIKey: GVGDDEYVTBKACE-UHFFFAOYSA-N
Reference
Crude bacterial extracts of two new Streptomyces sp. isolates as bio-colorants for textile dyeing
PubChem CID: 3581192
CAS: 145315-42-0
LOTUS: LTS0084742
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | None | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 195.22199999999995
TPSA？: 81.19
MolLogP？: 1.3554999999999997
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Histone acetyltransferase PCAF | IC50 | 5000.0 | nM | 10.1039/C5MD00209E |
| Homo sapiens | Histone acetyltransferase PCAF | IC50 | 5600.0 | nM | 10.1039/C1MD00201E |
| Severe acute respiratory syndrome coronavirus 2 | Replicase polyprotein 1ab | Inhibition | 25.48 | % | 10.6019/CHEMBL4495564 |
| Severe acute respiratory syndrome coronavirus 2 | SARS-CoV-2 | Inhibition | -0.06 | % | 10.6019/CHEMBL4495565 |