(3E)-3-[[1-(2-morpholin-4-yl-2-oxoethyl)indol-3-yl]methylidene]-1H-indol-2-one
Molecular Formula : C23H21N3O3 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |(3E)-3-[[1-(2-morpholin-4-yl-2-oxoethyl)indol-3-yl]methylidene]-1H-indol-2-one is a drug-like molecule.
MolName : (3E)-3-[[1-(2-morpholin-4-yl-2-oxoethyl)indol-3-yl]methylidene]-1H-indol-2-one |
MolecularFormula : C23H21N3O3 |
Smiles : O=C(Cn1c(cccc2)c2c(/C=C(\c(cccc2)c2N2)/C2=O)c1)N1CCOCC1 |
InChI : InChI=1S/C23H21N3O3/c27-22(25-9-11-29-12-10-25)15-26-14-16(17-5-2-4-8-21(17)26)13-19-18-6-1-3-7-20(18)24-23(19)28/h1-8,13-14H,9-12,15H2,(H,24,28) |
InChIK : WGIRIWJDSJJSDB-UHFFFAOYSA-N |
TotalMolweight : 387.438 |
Molweight : 387.438 |
MonoisotopicMass : 387.158292 |
CLogP : 1.6068 |
CLogS : -2.734 |
H Acceptors : 6 |
H Donors : 1 |
TotalSurfaceArea : 290.59 |
Relative PSA : 0.19946 |
PolarSurfaceArea : 63.57 |
Druglikeness : 4.772 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : |
Shape Index : 0.51724 |
Fragments : 1 |
Non HAtoms : 29 |
NonCHAtoms : 6 |
Electronegative Atoms : 6 |
Rotatable Bond : 3 |
Rings Closures : 5 |
Small Rings : 5 |
Aromatic Rings : 3 |
Aromatic Atoms : 15 |
Sp3Atoms : 6 |
Symmetricatoms : 2 |
Amides : 2 |
Aromatic Nitrogens : 1 |
StereoCon : |