Diplamine; N-De-Ac
AlkaPlorer ID: AK010342
Synonym: Diplamine B
IUPAC Name: 10-(2-aminoethyl)-11-methylsulfanyl-8,14-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,8,10,13,15-octaen-12-one
Structure
SMILES: CSC1=C(CCN)C2=NC3=CC=CC=C3C3=CC=NC(=C23)C1=O
InChI: InChI=1S/C18H15N3OS/c1-23-18-12(6-8-19)15-14-11(7-9-20-16(14)17(18)22)10-4-2-3-5-13(10)21-15/h2-5,7,9H,6,8,19H2,1H3
InChIKey: KEDRDGVCNOXHKD-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 321.4050000000001
TPSA？: 68.87
MolLogP？: 3.402200000000001
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | p53-binding protein Mdm-2 | Activity | nan | None | 10.1016/j.bmc.2008.10.024 |
| Homo sapiens | p53-binding protein Mdm-2 | IC50 | 101300.0 | nM | 10.1016/j.bmc.2008.10.024 |