Bioactive Compound Details

BioIDbio1085
NameCAERULOMYCIN C
ChEMBL IDCHEMBL1823038
Molecular FormulaC13H13N3O3
Molecular Weight259.27
Molecular Weight (Monoisotopic)259.0957
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsCaerulomycin C
SmilesCOc1cc(/C=N/O)nc(-c2ccccn2)c1OC
InchiInChI=1S/C13H13N3O3/c1-18-11-7-9(8-15-17)16-12(13(11)19-2)10-5-3-4-6-14-10/h3-8,17H,1-2H3/b15-8+
Inchi KeyWZBOHQZLZFLYKP-OVCLIPMQSA-N
Molecular SpeciesNEUTRAL
Targets8.0
Bioactivities8.0
Np Likeness Score-0.1
Records Key['8']
Records Name['Caerulomycin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure