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Chemical structure of PDAT

GC72947

PDAT

Also known as N-[2-(1H-indol-3-yl)ethyl]-N',N'-dimethylpropane-1,3-diamine

PDAT is a noncompetitive indoletlamine-N-metltransferase (INMT) inhibitor with a Ki of 84 μM for rabbit lung INMT (rabINMT)

ChemicalCAS1226213-83-7MW245.36FormulaC15H23N3
CAS number
1226213-83-7
Molecular weight
245.36
Formula
C15H23N3
InChIKey
WXDCWQNNGHIWNR-UHFFFAOYSA-N
Catalogue number
GC72947
Brand
GLPBIO
Computed properties PubChem CID 82085940 · XLogP 2.5 · TPSA 31.1 Ų · H-bond donors 2
XLogP
2.5
TPSA
31.1 Ų
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
7
Heavy atoms
18

SMILES CN(C)CCCNCCC1=CNC2=CC=CC=C21

Computed descriptors from PubChem (CID 82085940), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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