General
Preferred name
THIORPHAN
Synonyms
DL-Thiorphan ()
DL-3-Mercapto-2-benzylpropanoylglycine ()
NSC-727676 ()
Thiorphan-d5 ()
P&D ID
PD002605
CAS
93783-79-0
76721-89-6
2183240-70-0
Tags
available
drug candidate
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)
PRICE 135
DESCRIPTION Thiorphan is an neprilysin inhibitor (NEP; IC50 : 0.007 ??M).
DESCRIPTION Enkephalinase inhibitor (LOPAC library)
DESCRIPTION Thiorphan is an neprilysin inhibitor (NEP; IC50 : 0.007 μM). (TargetMol Bioactive Compound Library)
Compound Sets
9
Cayman Chemical Bioactives
ChEMBL Drugs
CZ-OPENSCREEN Bioactive Library
DrugMAP
LOPAC library
Prestwick Chemical Library
ReFrame library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
External IDs
30
Properties
(calculated by RDKit )
Molecular Weight
253.08
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
3
Rotatable Bonds
6
Ring Count
1
Aromatic Ring Count
1
cLogP
0.98
TPSA
66.4
Fraction CSP3
0.33
Chiral centers
1.0
Largest ring
6.0
QED
0.66
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Selectivity
Enkephalinase
Target
Neprilysin
Pathway
Metabolism
Source data