Bioactive Compound Details

BioIDbio181
NameDEHYDRONOTOAMIDE C
ChEMBL IDCHEMBL2332636
Molecular FormulaC26H29N3O4
Molecular Weight447.54
Molecular Weight (Monoisotopic)447.2158
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsDehydronotoamide C
SmilesC=CC(C)(C)[C@]1(C[C@@H]2NC(=O)C3=CCCN3C2=O)C(=O)Nc2c1ccc1c2C=CC(C)(C)O1
InchiInChI=1S/C26H29N3O4/c1-6-24(2,3)26(14-17-22(31)29-13-7-8-18(29)21(30)27-17)16-9-10-19-15(20(16)28-23(26)32)11-12-25(4,5)33-19/h6,8-12,17H,1,7,13-14H2,2-5H3,(H,27,30)(H,28,32)/t17-,26-/m0/s1
Inchi KeyBNEIQGIAKQAPAP-QLXKLKPCSA-N
Molecular SpeciesNEUTRAL
Targets10.0
Bioactivities10.0
Np Likeness Score2.43
Records Key['6']
Records Name['Dehydronotoamide C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure