General
Preferred name
INS(1,4,5)P3
Synonyms
D-myo-Inositol 1,4,5-trisphosphate hexapotassium salt ()
Ins(1,4,5)-P3 hexapotassium salt ()
1,4,5-IP3 hexapotassium salt ()
D-myo-inositol 1,4,5-trisphosphate ()
D-myo-Inositol-1,4,5-triphosphate (trisodium) ()
D-myo-Inositol 1,4,5-trisphosphate (tripotassium) ()
Inositol 1,4,5-trisphosphate (trisodium) ()
Ins(1,4,5)-P3 (trisodium) ()
Inositol 1,4,5-trisphosphate (tripotassium) ()
Ins(1,4,5)-P3 (tripotassium) ()
1D-myo-inositol 1,4,5-trisphosphate ()
D-myo-Inositol-1,4,5-triphosphate (sodium salt) ()
D-myo-Inositol-1,4,5-triphosphate (potassium salt) ()
IP3 ()
P&D ID
PD050148
CAS
85166-31-0
141611-10-1
141611-11-2
Tags
available
drug candidate
Drug indication
Discovery agent
Drug Status
experimental
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 D-myo-Inositol-1,4,5-triphosphate sodium salt is the trisodium salt of D-myo-Inositol 1,4,5-trisphosphate (1,4,5-IP3), which is a second messenger that stimulates the discharge of calcium from the endoplasmic reticulum.
Cell lines
4
Organisms
4
Compound Sets
10
Cayman Chemical Bioactives
10008205
60960
Concise Guide to Pharmacology 2017/18
4222
Concise Guide to Pharmacology 2019/20
4222
Concise Guide to Pharmacology 2021/22
4222
Concise Guide to Pharmacology 2023/24
4222
DrugBank
DB03401
DrugMAP
DMNUKIX
Guide to Pharmacology
4222
MedChem Express Bioactive Compound Library
HY-103642A
HY-150135B
Other bioactive compounds
External IDs
50
Properties
(calculated by RDKit )
Molecular Weight
419.96
Hydrogen Bond Acceptors
9
Hydrogen Bond Donors
9
Rotatable Bonds
6
Ring Count
1
Aromatic Ring Count
0
cLogP
-3.48
TPSA
260.97
Fraction CSP3
1.0
Chiral centers
6.0
Largest ring
6.0
QED
0.19
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
Calcium Channel
Pathway
Membrane Transporter/Ion Channel
Neuronal Signaling
Source data