(NZ)-N-(6-phenyl-6,7-dihydro-5H-isoquinolin-8-ylidene)hydroxylamine
Formula:C15H14N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-(6-phenyl-6,7-dihydro-5H-isoquinolin-8-ylidene)hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-(6-phenyl-6,7-dihydro-5H-isoquinolin-8-ylidene)hydroxylamine |
| MolecularFormula | C15H14N2O |
| Smiles | O/N=C(/CC(C1)c2ccccc2)\c2c1ccnc2 |
| InChI | InChI=1S/C15H14N2O/c18-17-15-9-13(11-4-2-1-3-5-11)8-12-6-7-16-10-14(12)15/h1-7,10,13,18H,8-9H2/t13-/m1/s1 |
| InChIK | IASQGCORANDLOA-CYBMUJFWSA-N |
| TotalMolweight | 238.289 |
| Molweight | 238.289 |
| MonoisotopicMass | 238.110613 |
| CLogP | 3.6305 |
| CLogS | -3.702 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 187.62 |
| Relative PSA | 0.18964 |
| PolarSurfaceArea | 45.48 |
| Druglikeness | -1.1612 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.55556 |
| Fragments | 1 |
| Non HAtoms | 18 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| StereoCenters | 1 |
| Rotatable Bond | 1 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 4 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon | racemate |
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1 - (NZ)-N-(6-phenyl-6,7-dihydro-5H-isoquinolin-8-ylidene)hydroxylamine | 2 - (NZ)-N-(6-phenyl-6,7-dihydro-5H-isoquinolin-8-ylidene)hydroxylamine
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