(NE)-N-(5-chloro-2,3-dihydroinden-1-ylidene)hydroxylamine
Formula:C9H8NOCl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-(5-chloro-2,3-dihydroinden-1-ylidene)hydroxylamine is a drug-like molecule.
| MolName | (NE)-N-(5-chloro-2,3-dihydroinden-1-ylidene)hydroxylamine |
| MolecularFormula | C9H8NOCl |
| Smiles | O/N=C(\CC1)/c(cc2)c1cc2Cl |
| InChI | InChI=1S/C9H8ClNO/c10-7-2-3-8-6(5-7)1-4-9(8)11-12/h2-3,5,12H,1,4H2 |
| InChIK | UQTIJEKCRQCDEK-UHFFFAOYSA-N |
| TotalMolweight | 181.622 |
| Molweight | 181.622 |
| MonoisotopicMass | 181.029441 |
| CLogP | 3.151 |
| CLogS | -3.73 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 132.02 |
| Relative PSA | 0.18641 |
| PolarSurfaceArea | 32.59 |
| Druglikeness | -2.0812 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 12 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 3 |
| StereoCon |
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1 - (NE)-N-(5-chloro-2,3-dihydroinden-1-ylidene)hydroxylamine | 2 - (NE)-N-(5-chloro-2,3-dihydroinden-1-ylidene)hydroxylamine
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