Compound	Isoliquiritigenin
NPACT-Id	NPACT00676
IUPAC	(E)-1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one
Synonyms	2',4,4'-Trihydroxychalcone; 6'-deoxychalcone
PubChem Id	638278
Class	Flavonoid
In-vitro anticancer activtiy	10 cancer cell lines
In-Vivo anticancer activtiy	No
Targets	AKT1 \| DDIT3 \| ICAM1 \| ITGA2 \| JUN \| MAPK8 \| MMP9 \| PLAU \| TIMP1 \| TIMP2 \| VCAM1 \| VEGFA \| All \|
Properties	Physical Elemental Topological
InChi Key	DXDRHHKMWQZJHT-FPYGCLRLSA-N
InChi	1S/C15H12O4/c16-11-4-1-10(2-5-11)3-8-14(18)13-7-6-12(17)9-15(13)19/h1-9,16-17,19H/b8-3+
SMILES	Oc1c(C(=O)/C=C/c2ccc(O)cc2)ccc(O)c1
SMART	[H]OC1=C([H])C([H])=C(C([H])=C(/[H])C(=O)C2=C(O[H])C([H])=C(O[H])C([H])=C2[H])C([H])=C1[H]
CAS No.	961-29-5
Structure Download
Cross Refrence in other databases
	Super Natural	000961295
	CTD	C040920
	HIT	C0298
	NCI-60 GI₅₀ data	-
Suppliers	ABI Chem, AKos Consulting & Solutions, Amadis Chemical, Ambinter, ChemMol, IS Chemical Technology, MolPort, R&D Chemicals, Selleck Chemicals, Sigma-Aldrich, TimTec, ZINC,
Drug-Likeliness Filters	Lipinski's rule of five	Yes
	Ghose filter	Yes
	Veber filter	Yes
	Muegge Filter	Yes
Similarity Search	Human metabolite database	FDA approved drugs

NPACT

Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase