Details of the Drug

General Information of Drug (ID: DMXZZP0)

Drug Name

BMS-181321

Synonyms

BMS-181032 (ligand); [[3',3'-[(1,3-Propanediyl)diimino]bis[3-methyl-1-(2-nitroimidazol-1-yl)-2-butanone]dioximato](3-)-N,N',N'',N''']oxotechnetium[99mTc]; [[[3,3,9,9-Tetramethyl-1-(2-nitroimidazol-1-yl)-4,8-diazaundecane-2,10-dione]dioximato](3-)-N,N',N'',N''']oxotechnetium[99mTc]

Indication

Disease Entry	ICD 11	Status	REF
Diagnostic imaging	N.A.	Investigative	[1]
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Drug Type

Small molecular drug

Structure

3D MOL is unavailable

2D MOL

Chemical Identifiers

Formula: C16H26N7O5Tc
Canonical SMILES: [H+].CC(=N[O-])C(C)(C)[N-]CCC[N-]C(C)(C)C(=N[O-])CN1C=CN=C1[N+](=O)[O-].O=[Tc+3]
InChI: 1S/C16H27N7O4.O.Tc/c1-12(20-24)15(2,3)18-7-6-8-19-16(4,5)13(21-25)11-22-10-9-17-14(22)23(26)27;;/h9-10,24-25H,6-8,11H2,1-5H3;;/q-2;;+3/p-1/b20-12+,21-13+;;/i;;1+1
InChIKey: BACDTMMAFRHWHW-KTZCKAEQSA-M

Cross-matching ID

PubChem CID: 9577288
CAS Number: 149447-21-2
TTD ID: D0A6OF

References

1	The ChEMBL database in 2017. Nucleic Acids Res. 2017 Jan 4;45(D1):D945-D954.