Bioactive Compound Details

BioIDbio2464
NameALTINICLINE MALEATE
ChEMBL IDCHEMBL2146093
Molecular FormulaC16H18N2O4
Molecular Weight302.33
Molecular Weight (Monoisotopic)186.1157
TypeSmall molecule
Max PhaseUnknown
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsALTINICLINE MALEATE|SIB-1508Y
SmilesC#Cc1cncc([C@@H]2CCCN2C)c1.O=C(O)/C=C/C(=O)O
InchiInChI=1S/C12H14N2.C4H4O4/c1-3-10-7-11(9-13-8-10)12-5-4-6-14(12)2;5-3(6)1-2-4(7)8/h1,7-9,12H,4-6H2,2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t12-;/m0./s1
Inchi KeyBCPPKHPWLRPWBJ-GYDOPSIJSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities4.0
Np Likeness Score-0.47
Records Key['ALTINICLINE', 'altinicline', 'altinicline', 'ALTINICLINE MALEATE']
Records Name['ALTINICLINE', 'altinicline', 'altinicline', 'ALTINICLINE MALEATE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure