Molecule

2-(2-Aminoethyl)-5-methoxyindole

AlkaPlorer ID: AK005645

Synonym: None

IUPAC Name: 2-(6-methoxy-1H-indol-3-yl)ethanamine

SMILES: COC1=CC2=C(C=C1)C(=CN2)CCN

InChI: InChI=1S/C11H14N2O/c1-14-9-2-3-10-8(4-5-12)7-13-11(10)6-9/h2-3,6-7,13H,4-5,12H2,1H3

InChIKey: VOCGEKMEZOPDFP-UHFFFAOYSA-N

PubChem CID: 17654

CAS: 2736-21-2

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain

Molecule Weight: 190.24599999999998

TPSA？: 51.04

MolLogP？: 1.6776999999999997

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 2

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Acinetobacter baumannii	Acinetobacter baumannii	MIC	60.8	ug.mL-1	10.1016/j.bmcl.2016.10.004
Bacillus subtilis	Bacillus subtilis	MIC	60.8	ug.mL-1	10.1016/j.bmcl.2016.10.004
Escherichia coli	Escherichia coli	MIC	60.8	ug.mL-1	10.1016/j.bmcl.2016.10.004
Homo sapiens	Serotonin 2a (5-HT2a) receptor	EC50	2443.0	nM	10.1016/j.bmcl.2014.07.062
Homo sapiens	Serotonin 2a (5-HT2a) receptor	Emax	111.0	%	10.1016/j.bmcl.2014.07.062
Homo sapiens	Voltage-gated potassium channel	IC50	1905460717963.24	nM	10.1021/jm060414o
Rattus norvegicus	Dopamine transporter	EC50	113.0	nM	10.1016/j.bmcl.2014.07.062
Rattus norvegicus	Hippocampus	Activity	nan	None	10.1021/jm060414o
Rattus norvegicus	Hippocampus	Inhibition	-10.0	%	10.1021/jm060414o
Rattus norvegicus	Norepinephrine transporter	EC50	465.0	nM	10.1016/j.bmcl.2014.07.062
Rattus norvegicus	Serotonin (5-HT) receptor	IC50	630.0	nM	10.1021/jm00367a008
Rattus norvegicus	Serotonin transporter	EC50	53.8	nM	10.1016/j.bmcl.2014.07.062
Staphylococcus aureus	Staphylococcus aureus	MIC	60.8	ug.mL-1	10.1016/j.bmcl.2016.10.004
None	Unchecked	IC50	524000.0	nM	10.1021/jm060414o
None	Unchecked	IC50	972000.0	nM	10.1021/jm060414o
None	Unchecked	Ratio IC50	1.9	None	10.1021/jm060414o