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plh

AlkaPlorer ID: AK324926

Synonym: None

IUPAC Name: (2R)-N'-hydroxy-N-[(2S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]-2-(2-methylpropyl)butanediamide

Structure

SMILES: CNC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC(=O)NO)CC(C)C

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InChI: InChI=1S/C18H27N3O4/c1-12(2)9-14(11-16(22)21-25)17(23)20-15(18(24)19-3)10-13-7-5-4-6-8-13/h4-8,12,14-15,25H,9-11H2,1-3H3,(H,19,24)(H,20,23)(H,21,22)/t14-,15+/m1/s1

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InChIKey: MOPRTFSMCQNUCT-CABCVRRESA-N

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Reference

PubChem CID: 194777

CAS: 108383-58-0

NPASS: NPC490491

Source

Species Genus Family Order Class Phylum Kingdom Domain

Properties Information

Molecule Weight: 349.4310000000001

TPSA？: 107.53000000000002

MolLogP？: 1.0176999999999996

Number of H-Donors: 4

Number of H-Acceptors: 4

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens Cathepsin L IC50 1000.0 nM 10.1016/s0960-894x(01)00755-7
Homo sapiens Cathepsin L IC50 1000.0 nM 10.1021/acs.jmedchem.1c00683
Homo sapiens Immunoglobulin epsilon Fc receptor IC50 1000.0 nM 10.1016/s0960-894x(97)10149-4
Homo sapiens Matrix metalloproteinase-1 IC50 3.0 nM 10.1016/s0960-894x(01)00755-7
Homo sapiens Matrix metalloproteinase-1 IC50 3.0 nM 10.1021/acs.jmedchem.1c00683
Homo sapiens Matrix metalloproteinase-1 IC50 25.0 nM 10.1016/j.ejmech.2007.07.002
Homo sapiens Matrix metalloproteinase-1 IC50 60.0 nM 10.1016/s0960-894x(97)10149-4
Homo sapiens Matrix metalloproteinase-1 Ki 6.0 nM 10.1016/0960-894X(95)00033-P
Homo sapiens Matrix metalloproteinase-1 Ki 7.0 nM 10.1016/0960-894X(95)00032-O
Homo sapiens Matrix metalloproteinase-1 Ki 7.0 nM 10.1021/jm00014a010
Homo sapiens Matrix metalloproteinase-2 IC50 0.7 nM 10.1016/j.ejmech.2007.07.002
Homo sapiens Matrix metalloproteinase-2 IC50 3.981 nM 10.1016/j.bmc.2007.01.011
Homo sapiens Matrix metalloproteinase 3 IC50 43.0 nM 10.1016/j.ejmech.2007.07.002
Homo sapiens Matrix metalloproteinase 3 Ki 79.0 nM 10.1016/0960-894X(95)00032-O
Homo sapiens Matrix metalloproteinase 3 Ki 79.0 nM 10.1021/jm00014a010
Homo sapiens Matrix metalloproteinase 3 Ki 79.43 nM 10.1016/j.bmc.2007.01.011
Homo sapiens Matrix metalloproteinase 3 Ki 89.0 nM 10.1016/0960-894X(95)00033-P
Homo sapiens Matrix metalloproteinase 7 IC50 8.3 nM 10.1016/j.ejmech.2007.07.002
Homo sapiens Matrix metalloproteinase 8 IC50 0.046 nM 10.1016/j.ejmech.2007.07.002
Homo sapiens Matrix metalloproteinase 8 Ki 1.0 nM 10.1016/0960-894X(95)00033-P
Homo sapiens Matrix metalloproteinase 8 Ki 2.0 nM 10.1016/0960-894X(95)00032-O
Homo sapiens Matrix metalloproteinase 8 Ki 2.0 nM 10.1021/jm00014a010
Homo sapiens Matrix metalloproteinase 9 IC50 0.38 nM 10.1016/j.ejmech.2007.07.002
Homo sapiens Matrix metalloproteinase 9 Ki 1.4 nM 10.1016/0960-894X(95)00033-P

Metabolism Information