Bioactive Compound Details

BioIDbio197820
NameCARINATUMINS B (2)
ChEMBL IDCHEMBL241838
Molecular FormulaC16H20N2O2
Molecular Weight272.35
Molecular Weight (Monoisotopic)272.1525
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsNone
SmilesCC1=C[C@H]2Cc3[nH]c(=O)ccc3[C@]3(C1)NCC[C@@H](O)[C@H]23
InchiInChI=1S/C16H20N2O2/c1-9-6-10-7-12-11(2-3-14(20)18-12)16(8-9)15(10)13(19)4-5-17-16/h2-3,6,10,13,15,17,19H,4-5,7-8H2,1H3,(H,18,20)/t10-,13+,15-,16-/m0/s1
Inchi KeyRGJUWLMFRYLAOJ-UXVLEFJLSA-N
Molecular SpeciesBASE
Targets1.0
Bioactivities1.0
Np Likeness Score2.2
Records Key['carinatumins B (2)']
Records Name['carinatumins B (2)']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure