Drug Information

General Information
Drug ID
DR00718
Drug Name
Tubercidin
Synonyms
Sparsamycin A
Drug Type
Small molecular drug
Indication Discovery agent [ICD11:N.A.] Investigative
Structure
3D MOL 2D MOL
Formula
C11H14N4O4
Canonical SMILES
C1=CN(C2=NC=NC(=C21)N)C3C(C(C(O3)CO)O)O
InChI
InChI=1S/C11H14N4O4/c12-9-5-1-2-15(10(5)14-4-13-9)11-8(18)7(17)6(3-16)19-11/h1-2,4,6-8,11,16-18H,3H2,(H2,12,13,14)/t6-,7-,8-,11-/m1/s1
InChIKey
HDZZVAMISRMYHH-KCGFPETGSA-N
CAS Number
CAS 69-33-0
Pharmaceutical Properties Molecular Weight 266.25 Topological Polar Surface Area 127
Heavy Atom Count 19 Rotatable Bond Count 2
Hydrogen Bond Donor Count 4 Hydrogen Bond Acceptor Count 7
XLogP
-1.3
PubChem CID
6245
PubChem SID
103171721 ,103914905 ,104311514 ,117356057 ,124812646 ,128047323 ,134971531 ,134978868 ,137248889 ,143236531 ,144187478 ,14872494 ,152146259 ,152198607 ,162202461 ,162250667 ,178101465 ,179561976 ,182462121 ,198982412 ,223702430 ,226399501 ,241383350 ,24899902 ,249864885 ,252072294 ,252212958 ,252403405 ,26757019 ,29225241 ,46392900 ,46530721 ,47193881 ,50040490 ,50506281 ,57323288 ,621129 ,7890700 ,7980854 ,8153925 ,92474076 ,93166873
ChEBI ID
CHEBI:48267
TTD Drug ID
D0H6WV
DT(s) Transporting This Drug ENT3 Transporter Info Equilibrative nucleoside transporter 3 Substrate [1]
Drug-Transporter Activity Data
Drug-Transporter Activity Data ENT3 Transporter Info Km =1860 microM Xenopus Oocytes-ENT3 [1]
References
1 Functional characterization of novel human and mouse equilibrative nucleoside transporters (hENT3 and mENT3) located in intracellular membranes. J Biol Chem. 2005 Apr 22;280(16):15880-7.

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