General
Preferred name
DALCETRAPIB
Synonyms
JTT-705 ()
RO4607381 ()
Dalcetrapib（JTT-705） ()
Dalcetrapib??JTT-705?? ()
JTT-705 (Dalcetrapib) ()
Dalcetrapib (JTT-705) ()
Ro-4607381 ()
P&D ID
PD010582
CAS
211513-37-0
Tags
available
drug candidate
Drug indication
Acute coronary syndrome
Hyperlipidaemia
Cardiovascular disease
Drug Status
investigational
Max Phase
3.0
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 Dalcetrapib (JTT-705) is a cholesteryl ester transfer protein (CETP) inhibitor thioester prodrug. This class of agent was predicted to increase circulating HDL cholesterol as a mechanism to improve cardiovascular health. Dalcetrapib is one of several CETP inhibitors that have failed to demonstrate efficacy in clinical studies . (GtoPdb)
DESCRIPTION Dalcetrapib (JTT-705) is an orally active cholesteryl ester transfer protein (CETP) inhibitor with IC50s of 204.6 nM and 6 ¦ÌM against recombinant human (rh) CETP and human plasma CETP, respectively[1][2].
PRICE 65
DESCRIPTION Dalcetrapib (RO4607381), a rhCETP inhibitor (IC50=0.2 ??M), increases the plasma HDL cholesterol.
DESCRIPTION Dalcetrapib (RO4607381), a rhCETP inhibitor (IC50=0.2 μM), increases the plasma HDL cholesterol. (TargetMol Bioactive Compound Library)
Compound Sets
15
AdooQ Bioactive Compound Library
A11213
Axon Medchem Screening Library
1962
Cayman Chemical Bioactives
89450
ChEMBL Drugs
CHEMBL313006
Drug Repurposing Hub
DrugBank
DB12181
DrugMAP
DMKNCVM
Guide to Pharmacology
12972
LSP-MoA library (Laboratory of Systems Pharmacology)
CHEMBL313006
Mcule NIBR MoA Box Subset
MCULE-1065383104
MedChem Express Bioactive Compound Library
HY-14950
Novartis Chemogenetic Library (NIBR MoA Box)
ReFrame library
Selleckchem Bioactive Compound Library
dalcetrapib-jtt-705
TargetMol Bioactive Compound Library
T6048
External IDs
32
Properties
(calculated by RDKit )
Molecular Weight
389.24
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
1
Rotatable Bonds
8
Ring Count
2
Aromatic Ring Count
1
cLogP
6.68
TPSA
46.17
Fraction CSP3
0.65
Chiral centers
0.0
Largest ring
6.0
QED
0.5
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
CETP
rhCETP
CETP inhibitor
Member status
member
MOA
Cholesteryl Ester Transfer Protein (CETP) Inhibitors
cholesteryl ester transfer protein inhibitor
Pathway
Metabolism
Metabolic Enzyme/Protease
Source data