(3E)-3-[[1-[(3-fluorophenyl)methyl]indol-3-yl]methylidene]-1H-indol-2-one
Formula:C24H17N2OF
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(3E)-3-[[1-[(3-fluorophenyl)methyl]indol-3-yl]methylidene]-1H-indol-2-one is a drug-like molecule.
| MolName | (3E)-3-[[1-[(3-fluorophenyl)methyl]indol-3-yl]methylidene]-1H-indol-2-one |
| MolecularFormula | C24H17N2OF |
| Smiles | O=C1Nc(cccc2)c2/C1=C\c1cn(Cc2cccc(F)c2)c2c1cccc2 |
| InChI | InChI=1S/C24H17FN2O/c25-18-7-5-6-16(12-18)14-27-15-17(19-8-2-4-11-23(19)27)13-21-20-9-1-3-10-22(20)26-24(21)28/h1-13,15H,14H2,(H,26,28) |
| InChIK | RDLPPNVKSURZRJ-UHFFFAOYSA-N |
| TotalMolweight | 368.41 |
| Molweight | 368.41 |
| MonoisotopicMass | 368.132491 |
| CLogP | 3.8962 |
| CLogS | -4.661 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 277.11 |
| Relative PSA | 0.1132 |
| PolarSurfaceArea | 34.03 |
| Druglikeness | 3.0129 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 3 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 21 |
| Sp3Atoms | 1 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - (3E)-3-[[1-[(3-fluorophenyl)methyl]indol-3-yl]methylidene]-1H-indol-2-one | 2 - (3E)-3-[[1-[(3-fluorophenyl)methyl]indol-3-yl]methylidene]-1H-indol-2-one
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