3-amino-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide
Formula:C14H13N3O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
3-amino-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide is a drug-like molecule.
| MolName | 3-amino-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide |
| MolecularFormula | C14H13N3O2 |
| Smiles | Nc1cccc(C(N/N=C\c2cc(O)ccc2)=O)c1 |
| InChI | InChI=1S/C14H13N3O2/c15-12-5-2-4-11(8-12)14(19)17-16-9-10-3-1-6-13(18)7-10/h1-9,18H,15H2,(H,17,19) |
| InChIK | QGZACXTZADECAC-UHFFFAOYSA-N |
| TotalMolweight | 255.276 |
| Molweight | 255.276 |
| MonoisotopicMass | 255.100777 |
| CLogP | 2.1786 |
| CLogS | -3.501 |
| H Acceptors | 5 |
| H Donors | 3 |
| TotalSurfaceArea | 201.86 |
| Relative PSA | 0.31893 |
| PolarSurfaceArea | 87.71 |
| Druglikeness | 4.3505 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.63158 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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