Details of the Drug

General Information of Drug (ID: DME0TZU)

Drug Name

2,7-diaminoanthraquinone

Synonyms

2,7-Diaminoanthraquinone; 2,7-Diaminoanthrachinon; BRN 2809381; 605-44-7; 2,7-Diaminoanthrachinon [Czech]; 2,7-diaminoanthracene-9,10-dione; 9,10-Anthracenedione, 2,7-diamino- (9CI); ANTHRAQUINONE, 2,7-DIAMINO-; 9,10-Anthracenedione, 2,7-diamino-; AC1L1Y5O; SCHEMBL3135129; CHEMBL454957; CTK5B1667; DTXSID20209235; KJNHYKBXQOSFJR-UHFFFAOYSA-N; ZINC31483469; 9,10-Anthracenedione,2,7-diamino-; AKOS030561506

Indication

Disease Entry	ICD 11	Status	REF
Discovery agent	N.A.	Investigative	[1]
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Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

#Ro5 Violations (Lipinski): 0

Molecular Weight (mw)

238.24

Logarithm of the Partition Coefficient (xlogp)

1.5

Rotatable Bond Count (rotbonds)

0

Hydrogen Bond Donor Count (hbonddonor)

2

Hydrogen Bond Acceptor Count (hbondacc)

4

Chemical Identifiers

Formula: C14H10N2O2
IUPAC Name: 2,7-diaminoanthracene-9,10-dione
Canonical SMILES: C1=CC2=C(C=C1N)C(=O)C3=C(C2=O)C=CC(=C3)N
InChI: InChI=1S/C14H10N2O2/c15-7-1-3-9-11(5-7)14(18)12-6-8(16)2-4-10(12)13(9)17/h1-6H,15-16H2
InChIKey: KJNHYKBXQOSFJR-UHFFFAOYSA-N

Cross-matching ID

PubChem CID: 11798
CAS Number: 605-44-7
TTD ID: D0G7NE

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
TERT messenger RNA (TERT mRNA)	TTQY2EJ	TERT_HUMAN	Inhibitor	[1]

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Molecular Interaction Atlas (MIA)

MIA Detail

Jump to Detail Molecular Interaction Atlas of This Drug

References

1	Synthesis, human telomerase inhibition and anti-proliferative studies of a series of 2,7-bis-substituted amido-anthraquinone derivatives. Bioorg Med Chem. 2008 Jul 15;16(14):6976-86.