NAV

Tetulomab tetraxetan Lu-177

This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.

Identification

Generic Name
Tetulomab tetraxetan Lu-177
DrugBank Accession Number
DB12227
Background

Betalutin has been used in trials studying the treatment of Non-Hodgkin Lymphoma and Relapsed, Diffuse Large B-cell Lymphoma.

Type
Small Molecule
Groups
Investigational
Structure
Similar Structures
Weight
Average: 697.81
Monoisotopic: 697.310511915
Chemical Formula
C30H47N7O10S
Synonyms
  • 177Lu-tetraxetan-tetulomab
  • 177Lu-tetulomab
  • Anti-CD37 antibody tetulomab tetraxetan Lu-177
  • Betalutin
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Pharmacology

Indication

Not Available

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Contraindications & Blackbox Warnings
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Pharmacodynamics

Not Available

Mechanism of action
Not Available
Absorption

Not Available

Volume of distribution

Not Available

Protein binding

Not Available

Metabolism
Not Available
Route of elimination

Not Available

Half-life

Not Available

Clearance

Not Available

Adverse Effects
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Toxicity

Not Available

Pathways
Not Available
Pharmacogenomic Effects/ADRs
Not Available

Interactions

Drug Interactions
This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.
Not Available
Food Interactions
Not Available

Categories

Drug Categories
Chemical TaxonomyProvided by Classyfire
Description
This compound belongs to the class of organic compounds known as pentacarboxylic acids and derivatives. These are carboxylic acids containing exactly five carboxyl groups.
Kingdom
Organic compounds
Super Class
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Sub Class
Pentacarboxylic acids and derivatives
Direct Parent
Pentacarboxylic acids and derivatives
Alternative Parents
N-phenylthioureas / L-alpha-amino acids / Aralkylamines / Trialkylamines / Thioureas / Amino acids / Carboxylic acids / Azacyclic compounds / Organopnictogen compounds / Organic oxides
show 3 more
Substituents
Alpha-amino acid / Alpha-amino acid or derivatives / Amine / Amino acid / Amino acid or derivatives / Aralkylamine / Aromatic heteromonocyclic compound / Azacycle / Benzenoid / Carbonyl group
show 19 more
Molecular Framework
Aromatic heteromonocyclic compounds
External Descriptors
Not Available
Affected organisms
Not Available

Chemical Identifiers

UNII
6QU69VIG75
CAS number
Not Available
InChI Key
RMJFCRKHOJOLIN-CGAIIQECSA-N
InChI
InChI=1S/C30H47N7O10S/c31-24(29(46)47)3-1-2-8-32-30(48)33-22-6-4-21(5-7-22)15-23-16-36(19-27(42)43)12-11-34(17-25(38)39)9-10-35(18-26(40)41)13-14-37(23)20-28(44)45/h4-7,23-24H,1-3,8-20,31H2,(H,38,39)(H,40,41)(H,42,43)(H,44,45)(H,46,47)(H2,32,33,48)/t23?,24-/m0/s1
IUPAC Name
(2S)-2-amino-6-{[(4-{[1,4,7,10-tetrakis(carboxymethyl)-1,4,7,10-tetraazacyclododecan-2-yl]methyl}phenyl)carbamothioyl]amino}hexanoic acid
SMILES
N[C@@H](CCCCNC(=S)NC1=CC=C(CC2CN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CCN2CC(O)=O)C=C1)C(O)=O

References

General References
Not Available
PubChem Compound
131704322
PubChem Substance
347828506
ChemSpider
32698108

Clinical Trials

Clinical Trials
PhaseStatusPurposeConditionsCount
1CompletedTreatmentFollicular Lymphoma ( FL) / Non-Hodgkin's Lymphoma (NHL) / Relapsed Follicular Lymphoma1
1CompletedTreatmentRefractory Diffuse Large B Cell Lymphoma (DLBCL) / Relapsed Diffuse Large B-cell Lymphoma (DLBCL)1
1WithdrawnTreatmentNon-Hodgkin's Lymphoma (NHL)1
1, 2CompletedTreatmentFollicular Lymphoma ( FL) / Non-Hodgkin's Lymphoma (NHL)1

Pharmacoeconomics

Manufacturers
Not Available
Packagers
Not Available
Dosage Forms
Not Available
Prices
Not Available
Patents
Not Available

Properties

State
Not Available
Experimental Properties
Not Available
Predicted Properties
PropertyValueSource
Water Solubility0.14 mg/mLALOGPS
logP-1.2ALOGPS
logP-6.8Chemaxon
logS-3.7ALOGPS
pKa (Strongest Acidic)1.07Chemaxon
pKa (Strongest Basic)9.97Chemaxon
Physiological Charge-3Chemaxon
Hydrogen Acceptor Count15Chemaxon
Hydrogen Donor Count8Chemaxon
Polar Surface Area249.54 Å2Chemaxon
Rotatable Bond Count17Chemaxon
Refractivity179.77 m3·mol-1Chemaxon
Polarizability72.8 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability0Chemaxon
Rule of FiveNoChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon
Predicted ADMET Features
Not Available

Spectra

Mass Spec (NIST)
Not Available
Spectra
SpectrumSpectrum TypeSplash Key
Predicted MS/MS Spectrum - 10V, Positive (Annotated)Predicted LC-MS/MSsplash10-000t-0000009000-70e5b78f65d65b556d34
Predicted MS/MS Spectrum - 10V, Negative (Annotated)Predicted LC-MS/MSsplash10-014i-0000019000-be2f8baa77faec818094
Predicted MS/MS Spectrum - 20V, Positive (Annotated)Predicted LC-MS/MSsplash10-0ue9-2100069000-93549a3162f1a011f370
Predicted MS/MS Spectrum - 20V, Negative (Annotated)Predicted LC-MS/MSsplash10-0a4i-2200292000-9bd9081be2a1146cbae8
Predicted MS/MS Spectrum - 40V, Positive (Annotated)Predicted LC-MS/MSsplash10-0ue9-6200094000-a55e2ed1c68c2f525889
Predicted MS/MS Spectrum - 40V, Negative (Annotated)Predicted LC-MS/MSsplash10-0a4i-7000593000-001b6307d3f022d3c25d
Chromatographic Properties
Collision Cross Sections (CCS)
AdductCCS Value (Å2)Source typeSource
[M-H]-237.50482
predicted
DeepCCS 1.0 (2019)
[M+H]+239.81065
predicted
DeepCCS 1.0 (2019)
[M+Na]+245.63545
predicted
DeepCCS 1.0 (2019)

Drug created at October 20, 2016 21:40 / Updated at December 01, 2022 11:27