BDBM44351 (2S)-6-amino-2-[[(2S)-3-methyl-2-[[(2S)-2-(methylamino)-1-oxopropyl]amino]-1-oxobutyl]amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)hexanamide;formic acid::(2S)-6-amino-2-[[(2S)-3-methyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)hexanamide;formic acid::(2S)-6-amino-2-[[(2S)-3-methyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]amino]-N-tetralin-1-yl-hexanamide;formic acid::(2S)-6-azanyl-2-[[(2S)-3-methyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]amino]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)hexanamide;methanoic acid::MLS-0425207.0001::cid_44229032

SMILES: CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)NC1CCCc2ccccc12

InChI Key: InChIKey=ACRWISXTPYKIAR-JISQLEEYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 44351   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
X-linked inhibitor of apoptosis protein (XIAP) (Homo sapiens (Human))	BDBM44351 ((2S)-6-amino-2-[[(2S)-3-methyl-2-[[(2S)-2-(methyla...) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)NC1CCCc2ccccc12 Show InChI InChI=1S/C25H41N5O3/c1-16(2)22(30-23(31)17(3)27-4)25(33)29-21(13-7-8-15-26)24(32)28-20-14-9-11-18-10-5-6-12-19(18)20/h5-6,10,12,16-17,20-22,27H,7-9,11,13-15,26H2,1-4H3,(H,28,32)(H,29,33)(H,30,31)/t17-,20?,21-,22-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q29W0CWK
					More data for this Ligand-Target Pair
X-linked inhibitor of apoptosis protein (XIAP) (Homo sapiens (Human))	BDBM44351 ((2S)-6-amino-2-[[(2S)-3-methyl-2-[[(2S)-2-(methyla...) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)NC1CCCc2ccccc12 Show InChI InChI=1S/C25H41N5O3/c1-16(2)22(30-23(31)17(3)27-4)25(33)29-21(13-7-8-15-26)24(32)28-20-14-9-11-18-10-5-6-12-19(18)20/h5-6,10,12,16-17,20-22,27H,7-9,11,13-15,26H2,1-4H3,(H,28,32)(H,29,33)(H,30,31)/t17-,20?,21-,22-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2FN14KV
					More data for this Ligand-Target Pair