Molecule

Eupolauridine

AlkaPlorer ID: AK035651

Synonym: None

IUPAC Name: 2,8-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5(16),6,8,10,12,14-octaene

SMILES: C1=CC=C2C(=C1)C1=NC=CC3=CC=NC2=C13

InChI: InChI=1S/C14H8N2/c1-2-4-11-10(3-1)13-12-9(5-7-15-13)6-8-16-14(11)12/h1-8H

InChIKey: KIVUUVOREYMMFE-UHFFFAOYSA-N

PubChem CID: 72486

CAS: 58786-39-3

LOTUS: LTS0194660

SuperNatural Ⅲ: SN0186834

COCONUT: CNP0113267

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Cleistopholis patens	Cleistopholis	Annonaceae	Magnoliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 204.232

TPSA？: 25.78

MolLogP？: 3.277200000000001

Number of H-Donors: 0

Number of H-Acceptors: 2

RingCount: 4

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Candida albicans	Candida albicans	MIC	1.56	ug.mL-1	10.1021/np50053a037
Homo sapiens	A2780	IC50	35700.0	nM	10.1021/np200093n
Homo sapiens	DNA topoisomerase I	IC50	4.2	ug.mL-1	10.1016/j.bmc.2016.02.028
Homo sapiens	NCI-H460	IC50	100000.0	nM	10.1021/np200093n
Plasmodium falciparum	Plasmodium falciparum	Activity	nan	None	10.1016/j.bmc.2016.02.028
Pseudomonas aeruginosa	Pseudomonas aeruginosa	IC50	5.0	ug.mL-1	10.1016/j.bmc.2016.02.028
None	NON-PROTEIN TARGET	GI	nan	None	10.1016/j.bmc.2016.02.028
None	NON-PROTEIN TARGET	IC50	4.8	ug.mL-1	10.1016/j.bmc.2016.02.028
None	NON-PROTEIN TARGET	IC50	5.25	ug.mL-1	10.1016/j.bmc.2016.02.028
None	NON-PROTEIN TARGET	IC50	10.0	ug.mL-1	10.1016/j.bmc.2016.02.028
None	NON-PROTEIN TARGET	MIC80	2.0	ug.mL-1	10.1016/j.bmc.2016.02.028
None	NON-PROTEIN TARGET	MIC80	12.5	ug.mL-1	10.1016/j.bmc.2016.02.028
None	NON-PROTEIN TARGET	MIC80	25.0	ug.mL-1	10.1016/j.bmc.2016.02.028
None	Unchecked	IC50	6.5	ug.mL-1	10.1016/j.bmc.2016.02.028
None	Unchecked	Ratio IC50	1.55	None	10.1016/j.bmc.2016.02.028