N-(2-Hydroxyethyl)cinnamamide
AlkaPlorer ID: AK301112
Synonym: N-(2-Hydroxyethyl)-3-phenyl-2-propenamide, Idrocilamide, Brolitene, Srilane, Talval, LCB 29
IUPAC Name: (Z)-N-(2-hydroxyethyl)-3-phenylprop-2-enamide
Structure
SMILES: O=C(/C=C\C1=CC=CC=C1)NCCO
InChI: InChI=1S/C11H13NO2/c13-9-8-12-11(14)7-6-10-4-2-1-3-5-10/h1-7,13H,8-9H2,(H,12,14)/b7-6-
InChIKey: OSCTXCOERRNGLW-SREVYHEPSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Erythrophleum chlorostachys | Erythrophleum | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 191.23
TPSA？: 49.33
MolLogP？: 0.8083
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Shigella dysenteriae | Shiga toxin subunit A | Delta Tm | -4.16 | degrees C | 10.1021/acs.jmedchem.6b01517 |
| Shigella dysenteriae | Shiga toxin subunit A | Ki | 37050.0 | nM | 10.1021/acs.jmedchem.6b01517 |
| None | NON-PROTEIN TARGET | MTD | 31.6 | uM | 10.1021/acs.jmedchem.6b01517 |