General
Preferred name
HEMATIN
Synonyms
Ferriheme ()
Ferriheme hydroxide ()
Ferrihemate ()
Ferrihemic acid ()
P&D ID
PD122328
CAS
15489-90-4
Tags
drug candidate
available
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)
PRICE 29
DESCRIPTION Hematin (Ferrihemic acid) is an iron-containing porphyrin. It is used for testing in vitro activities of the Rx-01 oxazolidinones against hospital and community pathogens. (TargetMol Bioactive Compound Library)
Compound Sets
3
DrugBank
MedChem Express Bioactive Compound Library
TargetMol Bioactive Compound Library
External IDs
12
Properties
(calculated by RDKit )
Molecular Weight
633.18
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
2
Rotatable Bonds
8
Ring Count
5
Aromatic Ring Count
3
cLogP
6.58
TPSA
158.58
Fraction CSP3
0.24
Chiral centers
0.0
Largest ring
16.0
QED
0.26
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Cytochrome P450
Pathway
Metabolic Enzyme/Protease
Source data