MetaADEDB 2.0 @ LMMD
Xanthine
(LRFVTYWOQMYALW-UHFFFAOYSA-N)
Structure
SMILES
O=c1[nH]c(=O)c2c([nH]1)nc[nH]2
Type(s)
Experimental
Molecular Formula:
C5H4N4O2
Molecular Weight:
152.111
Log P:
-1.0605
Hydrogen Bond Acceptor:
3
Hydrogen Bond Donor:
3
TPSA:
94.4
CAS Number(s):
69-89-6; 51953-16-3; 51953-25-4; 51953-26-5; 51953-27-6; 173793-02-7; 173793-03-8; 173793-05-0; 173793-06-1; 173793-08-3
Synonym(s)
1.
Xanthine
External Link(s)
MeSHD019820
PubChem Compound1188
BindingDB50227193
82009
ChEBI48517
17712
CHEMBLCHEMBL1424
DrugBankDB02134
IUPHAR/BPS Guide to PHARMACOLOGY4557
KEGGcpd:C00385
Therapeutic Target DatabaseD0M3IN
ZINC13517187
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Cocaine-Related Disorders19649617CTD
2Nerve Degeneration9147382CTD
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