N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide
Formula:C16H17N3O3
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide is a drug-like molecule.
| MolName | N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide |
| MolecularFormula | C16H17N3O3 |
| Smiles | O=C(c1ccccc1)N/N=C\c1ccc(N2CCOCC2)o1 |
| InChI | InChI=1S/C16H17N3O3/c20-16(13-4-2-1-3-5-13)18-17-12-14-6-7-15(22-14)19-8-10-21-11-9-19/h1-7,12H,8-11H2,(H,18,20) |
| InChIK | ZEIHADQQJAKDCC-UHFFFAOYSA-N |
| TotalMolweight | 299.329 |
| Molweight | 299.329 |
| MonoisotopicMass | 299.126992 |
| CLogP | 2.4107 |
| CLogS | -4.031 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 238.52 |
| Relative PSA | 0.26694 |
| PolarSurfaceArea | 67.07 |
| Druglikeness | 7.1425 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.68182 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 5 |
| Symmetricatoms | 4 |
| StereoCon |
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