General
Preferred name
T5-8
Synonyms
1,10-phenanthroline-5,6-dione ()
P&D ID
PD133998
CAS
27318-90-7
Tags
drug candidate
available
Drug indication
Discovery agent
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION T5-8 has been reported as an agonist of the bitter taste receptor TAS2R5 . It has been proposed as a novel bronchodilator that acts via agonism of TAS2R5 expressed in airway smooth muscle cells. (GtoPdb)
Cell lines
1
Organisms
0
Compound Sets
3
Concise Guide to Pharmacology 2021/22
11323
DrugMAP
DM5LVD2
Guide to Pharmacology
11323
External IDs
21
Properties
(calculated by RDKit )
Molecular Weight
210.04
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
0
Rotatable Bonds
0
Ring Count
3
Aromatic Ring Count
2
cLogP
1.52
TPSA
59.92
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.62
Structural alerts
2
quinone_D(2)
[#6]-1(-[#6]=,:[#6]-[#6]=,:[#6]-[#6]-1=[!#6&!#1])=[!#6&!#1]
PAINS Family C
imine_one_A(321)
[#6]-[#6](=[!#6&!#1;!R])-[#6](=[!#6&!#1;!R])-[$([#6]),$([#16](=[#8])=[#8])]
PAINS Family A
Custom attributes
(extracted from source data)
Source data