(3Z)-3-(2,3-dihydro-1-benzofuran-5-ylmethylidene)-1H-indol-2-one
Molecular Formula : C17H13NO2 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : high |(3Z)-3-(2,3-dihydro-1-benzofuran-5-ylmethylidene)-1H-indol-2-one is a drug-like molecule.
MolName : (3Z)-3-(2,3-dihydro-1-benzofuran-5-ylmethylidene)-1H-indol-2-one |
MolecularFormula : C17H13NO2 |
Smiles : O=C1Nc(cccc2)c2/C1=C/c(cc1)cc2c1OCC2 |
InChI : InChI=1S/C17H13NO2/c19-17-14(13-3-1-2-4-15(13)18-17)10-11-5-6-16-12(9-11)7-8-20-16/h1-6,9-10H,7-8H2,(H,18,19) |
InChIK : KPDJMHZKJOMUAZ-UHFFFAOYSA-N |
TotalMolweight : 263.295 |
Molweight : 263.295 |
MonoisotopicMass : 263.094629 |
CLogP : 2.4915 |
CLogS : -3.736 |
H Acceptors : 3 |
H Donors : 1 |
TotalSurfaceArea : 197.46 |
Relative PSA : 0.17472 |
PolarSurfaceArea : 38.33 |
Druglikeness : 2.1518 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : high |
Irritant : none |
Nasty Functions : |
Shape Index : 0.55 |
Fragments : 1 |
Non HAtoms : 20 |
NonCHAtoms : 3 |
Electronegative Atoms : 3 |
Rotatable Bond : 1 |
Rings Closures : 4 |
Small Rings : 4 |
Aromatic Rings : 2 |
Aromatic Atoms : 12 |
Sp3Atoms : 3 |
Amides : 1 |
StereoCon : |