General
Preferred name
inositol nicotinate
Synonyms
INOSITOL NIACINATE ()
Inositol hexanicotinate ()
Myo-Inositol hexanicotinate ()
Dilexpal ()
Hexanicotol ()
Mesotal ()
Hexopal ()
Hexanicit ()
Mesonex ()
Palohex ()
NSC-49506 ()
Dilcit ()
Esantene ()
Linodil ()
WIN 9154 ()
WIN-9154 ()
Hamovannid ()
P&D ID
PD072056
CAS
6556-11-2
Tags
available
drug
Approved by
FDA
Drug Status
approved
withdrawn
Drug indication
Vasodilator (peripheral)
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
9
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
27
Properties
(calculated by RDKit )
Molecular Weight
810.19
Hydrogen Bond Acceptors
18
Hydrogen Bond Donors
0
Rotatable Bonds
12
Ring Count
7
Aromatic Ring Count
6
cLogP
3.72
TPSA
235.14
Fraction CSP3
0.14
Chiral centers
0.0
Largest ring
6.0
QED
0.13
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Indication
statis dermatitis, claudication, Raynaud's disease, hypertension, insomnia, atherosclerosis, restless leg syndrome, schizophrenia, psoriasis, acne vulgaris (AV)
Disease Area
dermatology, cardiology, rheumatology, neurology/psychiatry
Source data