Bioactive Compound Details

BioIDbio2199
NameRS-9-Aminocamptothecin
ChEMBL IDCHEMBL315269
Molecular FormulaC20H17N3O4
Molecular Weight363.37
Molecular Weight (Monoisotopic)363.1219
TypeSmall molecule
Max Phase--
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsNone
SmilesCCC1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3c(N)cccc3nc2-1
InchiInChI=1S/C20H17N3O4/c1-2-20(26)13-7-16-17-10(6-11-14(21)4-3-5-15(11)22-17)8-23(16)18(24)12(13)9-27-19(20)25/h3-7,26H,2,8-9,21H2,1H3
Inchi KeyFUXVKZWTXQUGMW-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets86.0
Bioactivities96.0
Np Likeness Score1.02
Records Key['SID494811', '5f', 'SID92763359']
Records Name['SID494811', '(20RS)-10-Amino-4-ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione', 'SID92763359']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure