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Chemical structure of PD 146176

GC12205

PD 146176

Also known as 6,11-dihydrothiochromeno[4,3-b]indole

PD 146176 is one of the potent and selective inhibitors of reticulocyte 15-LOX-1

ChemicalCAS4079-26-9MW237.32FormulaC15H11NS
CAS number
4079-26-9
Molecular weight
237.32
Formula
C15H11NS
Solubility
DMF： 10 mg/ml,DMF：PBS (pH 7·2) (1：5)： 0·15 mg/ml,DMSO： 10 mg/ml,Ethanol： 2 mg/ml
InChIKey
ZGOOPZVQMLHPFM-UHFFFAOYSA-N
Catalogue number
GC12205
Brand
GLPBIO
Computed properties PubChem CID 297589 · XLogP 3.8 · TPSA 41.1 Ų · H-bond donors 1
XLogP
3.8
TPSA
41.1 Ų
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
17

SMILES C1C2=C(C3=CC=CC=C3S1)NC4=CC=CC=C24

Computed descriptors from PubChem (CID 297589), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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