MetaADEDB 2.0 @ LMMD
icilin
(RCEFMOGVOYEGJN-UHFFFAOYSA-N)
Structure
SMILES
O=C1NC(=CCN1c1ccccc1O)c1cccc(c1)[N+](=O)[O-]
Molecular Formula:
C16H13N3O4
Molecular Weight:
311.292
Log P:
3.7881
Hydrogen Bond Acceptor:
4
Hydrogen Bond Donor:
2
TPSA:
98.39
CAS Number(s):
36945-98-9
Synonym(s)
1.
icilin
2.
1-(2-hydroxyphenyl)-4-(3-nitrophenyl)-1,2,3,6-tetrahydropyrimidin-2-one
3.
AG 3-5
4.
AG-3-5 compound
External Link(s)
MeSHC490483
PubChem Compound161930
BindingDB50241426
ChEBI92845
CHEMBLCHEMBL258405
IUPHAR/BPS Guide to PHARMACOLOGY2429
KEGGcpd:C20171
Therapeutic Target DatabaseD04ULU
ZINC620751
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Edema23596210CTD
2Erythema23596210CTD
3Neuralgia16920620CTD
4Neurobehavioral Manifestations21128593CTD
5Ulcer23596210CTD
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