IBD Research Resource Center

BioID	bio198160
Name	PAULLONE 2
ChEMBL ID	CHEMBL299756
Molecular Formula	C17H11N3O
Molecular Weight	273.3
Molecular Weight (Monoisotopic)	273.0902
Type	Small molecule
Max Phase	--
Target ID	Tar81
Target Name	None
Synonyms	Paullone 2
Smiles	N#Cc1ccc2[nH]c3c(c2c1)CC(=O)Nc1ccccc1-3
Inchi	InChI=1S/C17H11N3O/c18-9-10-5-6-15-12(7-10)13-8-16(21)19-14-4-2-1-3-11(14)17(13)20-15/h1-7,20H,8H2,(H,19,21)
Inchi Key	LBVIZFWUIQSZHP-UHFFFAOYSA-N
Molecular Species	NEUTRAL
Targets	64.0
Bioactivities	70.0
Np Likeness Score	-0.5
Records Key	['28c', 'SID528514', '1g', '32', '4', '6', '4i', '6, Paullone 2', '9-Cyanopaullone']
Records Name	['6-Oxo-5,6,7,12-tetrahydro-benzo[2,3]azepino[4,5-b]indole-9-carbonitrile', 'SID528514', '6-Oxo-5,6,7,12-tetrahydro-benzo[2,3]azepino[4,5-b]indole-9-carbonitrile', '6-Oxo-5,6,7,12-tetrahydro-benzo[2,3]azepino[4,5-b]indole-9-carbonitrile', '6-oxo-5,6,7,12-tetrahydro-benzo[2,3]azepino[4,5-b]indole-9-carbonitrile', 'Paullone 2', '6-Oxo-5,6,7,12-tetrahydro-benzo[2,3]azepino[4,5-b]indole-9-carbonitrile', '6-oxo-5,6,7,12-tetrahydro-benzo[2,3]azepino[4,5-b]indole-9-carbonitrile', '9-Cyanopaullone']
Withdrawn Flag	False
Orphan	-1