Bioactive Compound Details

BioIDbio1792
NameOKARAMINE C
ChEMBL IDCHEMBL2288240
Molecular FormulaC32H36N4O3
Molecular Weight524.67
Molecular Weight (Monoisotopic)524.2787
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsNone
SmilesC=CC(C)(C)c1[nH]c2ccccc2c1CC1NC(=O)[C@H]2C[C@@]3(O)c4ccccc4N(C(C)(C)C=C)[C@H]3N2C1=O
InchiInChI=1S/C32H36N4O3/c1-7-30(3,4)26-20(19-13-9-11-15-22(19)33-26)17-23-28(38)35-25(27(37)34-23)18-32(39)21-14-10-12-16-24(21)36(29(32)35)31(5,6)8-2/h7-16,23,25,29,33,39H,1-2,17-18H2,3-6H3,(H,34,37)/t23?,25-,29-,32-/m1/s1
Inchi KeyYWLAQSLUIQTZON-RECIGGTHSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score1.73
Records Key['3']
Records Name['Okaramine C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure