OCTAAMINOACRIDINE

Search structure


Status:	Phase 3
Entry Type:	Small molecule
Molecule Category:	UNKNOWN
UNII:	2YM9179F4V

Structure


InChI Key	BMRFESVZYWRROS-UHFFFAOYSA-N
Smile	Nc1c2c(nc3c1CCCC3)CCCC2
InChI	InChI=1S/C13H18N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H2,(H2,14,15)

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C13H18N2
Molecular Weight	202.3
AlogP	2.42
Hydrogen Bond Acceptor	2.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	0.0
Polar Surface Area	38.91
Molecular species	BASE
Aromatic Rings	1.0
Heavy Atoms	15.0

Pharmacology

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Enzyme Hydrolase	-	360	-	-	-

Cross References

Resources	Reference
ChEMBL	CHEMBL263198
EPA CompTox	DTXSID80158573
FDA SRS	2YM9179F4V
SureChEMBL	SCHEMBL12507982
ZINC	ZINC000000330064

CONTENTS