6IP

6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-2-AMINE

Created:	2007-01-12
Last modified:	2011-06-04

Find Related PDB Entry
1 entries where 6IP is found as a standalone ligand

Help Find related ligands:
Similar Ligands (Stereospecific) Similar Ligands (including Stereoisomers) Similar Ligands (Quick Screen) Similar Ligands (Substructure Stereospecific) Similar Ligands (Substructure including Stereoisomers)

Help

Find related ligands:

Similar Ligands (Stereospecific) Similar Ligands (including Stereoisomers) Similar Ligands (Quick Screen) Similar Ligands (Substructure Stereospecific) Similar Ligands (Substructure including Stereoisomers)

Chemical Details
Formal Charge	0
Atom Count	33
Chiral Atom Count	0
Bond Count	35
Aromatic Bond Count	16

Toggle Hydrogen Toggle Labels

Chemical Component Summary
Name	6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-2-AMINE
Systematic Name (OpenEye OEToolkits)	6-[2-(1H-indol-6-yl)ethyl]pyridin-2-amine
Formula	C₁₅ H₁₅ N₃
Molecular Weight	237.3
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	n1c(N)cccc1CCc2ccc3c(c2)ncc3
SMILES	CACTVS	3.341	Nc1cccc(CCc2ccc3cc[nH]c3c2)n1
SMILES	OpenEye OEToolkits	1.5.0	c1cc(nc(c1)N)CCc2ccc3cc[nH]c3c2
Canonical SMILES	CACTVS	3.341	Nc1cccc(CCc2ccc3cc[nH]c3c2)n1
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1cc(nc(c1)N)CCc2ccc3cc[nH]c3c2
InChI	InChI	1.03	InChI=1S/C15H15N3/c16-15-3-1-2-13(18-15)7-5-11-4-6-12-8-9-17-14(12)10-11/h1-4,6,8-10,17H,5,7H2,(H2,16,18)
InChIKey	InChI	1.03	OSHSZKRWKLQZBV-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB07206
Name	6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-2-AMINE
Groups	experimental
Synonyms	6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-2-AMINE

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Beta-secretase 1	MAQALPWLLLWMGAGVLPAHGTQHGIRLPLRSGLGGAPLGLRLPRETDEE...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682