(3Z)-3-[[1-(benzenesulfonyl)indol-2-yl]methylidene]-1H-indol-2-one
Formula:C23H16N2O3S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(3Z)-3-[[1-(benzenesulfonyl)indol-2-yl]methylidene]-1H-indol-2-one is a drug-like molecule.
| MolName | (3Z)-3-[[1-(benzenesulfonyl)indol-2-yl]methylidene]-1H-indol-2-one |
| MolecularFormula | C23H16N2O3S |
| Smiles | O=C1Nc(cccc2)c2/C1=C/c1cc(cccc2)c2n1S(c1ccccc1)(=O)=O |
| InChI | InChI=1S/C23H16N2O3S/c26-23-20(19-11-5-6-12-21(19)24-23)15-17-14-16-8-4-7-13-22(16)25(17)29(27,28)18-9-2-1-3-10-18/h1-15H,(H,24,26) |
| InChIK | QBDDZCHUMYYJRV-UHFFFAOYSA-N |
| TotalMolweight | 400.457 |
| Molweight | 400.457 |
| MonoisotopicMass | 400.088163 |
| CLogP | 2.6103 |
| CLogS | -7.417 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 285.58 |
| Relative PSA | 0.20992 |
| PolarSurfaceArea | 76.55 |
| Druglikeness | -2.2513 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.44828 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 3 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 21 |
| Sp3Atoms | 1 |
| Symmetricatoms | 3 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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