Compound	Diallyldisulfide
NPACT-Id	NPACT01189
IUPAC	-
Synonyms	Allyl disulfide;2-Propenyl disulphide;Allyl disulphide;Disulfide, di-2-propenyl;4,5-Dithia-1,7-octadiene;2-Propenyl disulfide;Di(2-propenyl) disulfide;3-(Allyldisulfanyl)-1-propene;3-(prop-2-enyldisulfanyl)prop-1-ene;
PubChem Id	16590
Class	Organic chemical
In-vitro anticancer activity	2 cancer cell lines
In-Vivo anticancer activity	Yes
Targets	BAX \| BCL2L1 \| CASP3 \| All \|
Properties	Physical Elemental Topological
InChi Key	PFRGXCVKLLPLIP-UHFFFAOYSA-N
InChi	1S/C6H10S2/c1-3-5-7-8-6-4-2/h3-4H,1-2,5-6H2
SMILES	S(SCC=C)CC=C
SMART	[H]C([H])=C(/[H])C([H])([H])SSC([H])([H])C([H])=C(/[H])[H]
CAS No.	2179-57-9
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C028009
	HIT	-
	NCI-60 GI₅₀ data	2179-57-9
Suppliers	ABI Chem, Amadis Chemical, Ambinter, ChemExper Chemical Directory, ChemFrog, Chemical Synthesis Database, ChemMol, IS Chemical Technology, Jamson Pharmachem Technology, MP Biomedicals, Sigma-Aldrich, TCI (Tokyo Chemical Industry), Tractus, ZINC,
Drug-Likeliness Filters	Lipinski's rule of five	Yes
	Ghose filter	No
	Veber filter	Yes
	Muegge Filter	No
Similarity Search	Human metabolite database	FDA approved drugs

NPACT

Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase