Bioactive Compound Details

BioIDbio3413
NameLANRAPLENIB SUCCINATE
ChEMBL IDCHEMBL4298174
Molecular FormulaC58H68N18O14
Molecular Weight1241.29
Molecular Weight (Monoisotopic)443.2182
TypeSmall molecule
Max PhasePhase 1
Target IDTar18
Target NameSerine/threonine-protein kinase cot (COT)
SynonymsGS-SYK Succinate|LANRAPLENIB SESQUISUCCINATE|LANRAPLENIB SUCCINATE
SmilesNc1cncc(-c2cn3ccnc3c(Nc3ccc(N4CCN(C5COC5)CC4)cc3)n2)n1.Nc1cncc(-c2cn3ccnc3c(Nc3ccc(N4CCN(C5COC5)CC4)cc3)n2)n1.O=C(O)CCC(=O)O.O=C(O)CCC(=O)O.O=C(O)CCC(=O)O
InchiInChI=1S/2C23H25N9O.3C4H6O4/c2*24-21-12-25-11-19(28-21)20-13-32-6-5-26-23(32)22(29-20)27-16-1-3-17(4-2-16)30-7-9-31(10-8-30)18-14-33-15-18;3*5-3(6)1-2-4(7)8/h2*1-6,11-13,18H,7-10,14-15H2,(H2,24,28)(H,27,29);3*1-2H2,(H,5,6)(H,7,8)
Inchi KeySUXNLHAGYIRFJQ-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score-1.25
Records Key['LANRAPLENIB SUCCINATE']
Records Name['LANRAPLENIB SUCCINATE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure