General
Preferred name
LODELABEN
Synonyms
DECLABEN ()
SC-39026 ()
P&D ID
PD067868
CAS
111149-90-7
Tags
available
drug candidate
Drug Status
investigational
Max Phase
2.0
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
PRICE
907
DESCRIPTION
Lodelaben (Declaben, SC-39026) is a reversible, non-competitive inhibitor of human neutrophil elastase (HNE), characterized by specificity and potency (IC50=0.5 ??M, Ki=1.5 ??M).
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
3
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
12
Molecular Weight
424.27
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
2
Rotatable Bonds
18
Ring Count
1
Aromatic Ring Count
1
cLogP
8.33
TPSA
57.53
Fraction CSP3
0.72
Chiral centers
1.0
Largest ring
6.0
QED
0.23
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
Elastase
Pathway
Metabolic Enzyme/Protease
Source data
