BDBM44320 (2S)-N-[(1S)-1-[(2S)-2-[(3-fluoroanilino)carbamoyl]pyrrolidine-1-carbonyl]-2-methyl-propyl]-2-(methylamino)propionamide;formic acid::(2S)-N-[(2S)-1-[(2S)-2-[(3-fluoroanilino)carbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]-2-(methylamino)propanamide;formic acid::(2S)-N-[(2S)-1-[(2S)-2-[[(3-fluorophenyl)amino]carbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-2-(methylamino)propanamide;methanoic acid::(2S)-N-[(2S)-1-[(2S)-2-[[(3-fluorophenyl)hydrazo]-oxomethyl]-1-pyrrolidinyl]-3-methyl-1-oxobutan-2-yl]-2-(methylamino)propanamide;formic acid::MLS-0412155.0001::cid_44182227

SMILES: CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)NNc1cccc(F)c1

InChI Key: InChIKey=DTFXFUTUIMILNU-JQFCIGGWSA-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 = 44320   

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))	BDBM44320 ((2S)-N-[(1S)-1-[(2S)-2-[(3-fluoroanilino)carbamoyl...) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)NNc1cccc(F)c1 Show InChI InChI=1S/C20H30FN5O3/c1-12(2)17(23-18(27)13(3)22-4)20(29)26-10-6-9-16(26)19(28)25-24-15-8-5-7-14(21)11-15/h5,7-8,11-13,16-17,22,24H,6,9-10H2,1-4H3,(H,23,27)(H,25,28)/t13-,16-,17-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	6.50E+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))	BDBM44320 ((2S)-N-[(1S)-1-[(2S)-2-[(3-fluoroanilino)carbamoyl...) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)NNc1cccc(F)c1 Show InChI InChI=1S/C20H30FN5O3/c1-12(2)17(23-18(27)13(3)22-4)20(29)26-10-6-9-16(26)19(28)25-24-15-8-5-7-14(21)11-15/h5,7-8,11-13,16-17,22,24H,6,9-10H2,1-4H3,(H,23,27)(H,25,28)/t13-,16-,17-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.70E+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