None
AlkaPlorer ID: AK323628
Synonym: None
IUPAC Name: (2S)-2-[[4-[[(2R)-2-amino-3-sulfanylpropanoyl]amino]benzoyl]amino]-4-methylsulfanylbutanoic acid
Structure
SMILES: CSCC[C@H](NC(=O)C1=CC=C(NC(=O)[C@@H](N)CS)C=C1)C(=O)O
InChI: InChI=1S/C15H21N3O4S2/c1-24-7-6-12(15(21)22)18-13(19)9-2-4-10(5-3-9)17-14(20)11(16)8-23/h2-5,11-12,23H,6-8,16H2,1H3,(H,17,20)(H,18,19)(H,21,22)/t11-,12-/m0/s1
InChIKey: QZVAZQOXHOMYJF-RYUDHWBXSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Mimosa diplotricha | Mimosa | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 371.4840000000001
TPSA？: 121.52
MolLogP？: 0.8182999999999998
Number of H-Donors: 5
Number of H-Acceptors: 6
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Geranylgeranyl transferase type I | IC50 | 100000.0 | nM | 10.1021/jm010297r |
| Homo sapiens | Protein farnesyltransferase | IC50 | 72.0 | nM | 10.1021/jm010297r |
| Homo sapiens | Protein farnesyltransferase | IC50 | 150.0 | nM | 10.1021/jm950414g |
| None | Unchecked | IC50 | 50.0 | nM | 10.1021/acs.jnatprod.6b00170 |
| None | Unchecked | IC50 | 72.0 | nM | 10.1021/jm030502y |
| None | Unchecked | IC50 | 100.0 | nM | 10.1021/acs.jnatprod.6b00170 |
| None | Unchecked | IC50 | 100.0 | nM | 10.1021/jm030502y |