ALTRETAMINE

Search structure
Trade Names:
Synonyms:
Status: Approved (1990)
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: L01XX03
UNII: Q8BIH59O7H

Structure
InChI Key UUVWYPNAQBNQJQ-UHFFFAOYSA-N
Smile CN(C)c1nc(N(C)C)nc(N(C)C)n1
InChI
InChI=1S/C9H18N6/c1-13(2)7-10-8(14(3)4)12-9(11-7)15(5)6/h1-6H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C9H18N6
Molecular Weight 210.28
AlogP 0.07
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 3.0
Polar Surface Area 48.39
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 15.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR DNA inhibitor DailyMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 101

Metabolites

visNetwork

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Lymphoma 1 D008223 ClinicalTrials
Sarcoma 1 D012509 ClinicalTrials

Adverse Reactions

SOC By Demographic Distribution
System Organ Classification (SOC)
Relative Frequency (%)
Gastrointestinal disorders
33.33
General disorders and administration site conditions
33.33
Nervous system disorders
33.33

Cross References

Resources Reference
CAS NUMBER 645-05-6
ChEBI 24564
ChEMBL CHEMBL1455
DrugBank DB00488
DrugCentral 141
EPA CompTox DTXSID4022579
FDA SRS Q8BIH59O7H
Human Metabolome Database HMDB0014631
Guide to Pharmacology 7112
PharmGKB PA164743136
PubChem 2123
SureChEMBL SCHEMBL4206
ZINC ZINC000000000905
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