General
Preferred name
ecallantide
Synonyms
P&D ID
PD155010
CAS
460738-38-9
Tags
drug
Drug indication
Retina venous occlusion
Drug Status
approved
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 This 60 amino acid peptide drug is an inhibitor of human plasma kallikrein (KLKB1; P03952). The recombinant protein is produced in yeast (Pichia pastoris).The chemical structure shown here was generated using the SMILES from PubChem CID 44152182. (GtoPdb)
Compound Sets
3
DrugMAP
DMOF2C6
DrugMAP Approved Drugs
DMOF2C6
Guide to Pharmacology
6955
External IDs
1
Properties
(calculated by RDKit )
Molecular Weight
7049.04
Hydrogen Bond Acceptors
99
Hydrogen Bond Donors
100
Rotatable Bonds
128
Ring Count
17
Aromatic Ring Count
12
cLogP
-28.14
TPSA
2912.95
Fraction CSP3
0.53
Chiral centers
60.0
Largest ring
78.0
QED
0.01
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data