Bioactive Compound Details

BioIDbio1399
NameNone
ChEMBL IDCHEMBL233670
Molecular FormulaC12H12N2O2
Molecular Weight216.24
Molecular Weight (Monoisotopic)216.0899
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonyms(11Ar)-Pyrrolo[2,1-C][1,4]Benzodiazepine
SmilesO=C1Nc2ccccc2C(=O)N2CCC[C@H]12
InchiInChI=1S/C12H12N2O2/c15-11-10-6-3-7-14(10)12(16)8-4-1-2-5-9(8)13-11/h1-2,4-5,10H,3,6-7H2,(H,13,15)/t10-/m1/s1
Inchi KeyMXBNEEHQIDLPLQ-SNVBAGLBSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities2.0
Np Likeness Score-0.04
Records Key['(R)-4', '37']
Records Name['(R)-1,2,3,11a-tetrahydro-10H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-5,11-dione', '(11aR)-Pyrrolo[2,1-c][1,4]benzodiazepine']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure