N-[(E)-2,3-dihydroinden-1-ylideneamino]-4-hydroxybenzamide
Formula:C16H14N2O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(E)-2,3-dihydroinden-1-ylideneamino]-4-hydroxybenzamide is a drug-like molecule.
| MolName | N-[(E)-2,3-dihydroinden-1-ylideneamino]-4-hydroxybenzamide |
| MolecularFormula | C16H14N2O2 |
| Smiles | Oc(cc1)ccc1C(N/N=C(\CC1)/c2c1cccc2)=O |
| InChI | InChI=1S/C16H14N2O2/c19-13-8-5-12(6-9-13)16(20)18-17-15-10-7-11-3-1-2-4-14(11)15/h1-6,8-9,19H,7,10H2,(H,18,20) |
| InChIK | GGWJWAOBDVZNFO-UHFFFAOYSA-N |
| TotalMolweight | 266.299 |
| Molweight | 266.299 |
| MonoisotopicMass | 266.105528 |
| CLogP | 3.1866 |
| CLogS | -4.104 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 205.57 |
| Relative PSA | 0.2389 |
| PolarSurfaceArea | 61.69 |
| Druglikeness | 2.3539 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.65 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - N-[(E)-2,3-dihydroinden-1-ylideneamino]-4-hydroxybenzamide | 2 - N-[(E)-2,3-dihydroinden-1-ylideneamino]-4-hydroxybenzamide
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