(NZ)-N-(2-chloro-7-nitrofluoren-9-ylidene)hydroxylamine
Formula:C13H7N2O3Cl
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
(NZ)-N-(2-chloro-7-nitrofluoren-9-ylidene)hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-(2-chloro-7-nitrofluoren-9-ylidene)hydroxylamine |
| MolecularFormula | C13H7N2O3Cl |
| Smiles | [O-][N+](c(cc1)cc2c1-c(ccc(Cl)c1)c1/C2=N\O)=O |
| InChI | InChI=1S/C13H7ClN2O3/c14-7-1-3-9-10-4-2-8(16(18)19)6-12(10)13(15-17)11(9)5-7/h1-6,17H |
| InChIK | GTVIOMFPUBELIT-UHFFFAOYSA-N |
| TotalMolweight | 274.663 |
| Molweight | 274.663 |
| MonoisotopicMass | 274.01452 |
| CLogP | 3.4817 |
| CLogS | -6.287 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 187.93 |
| Relative PSA | 0.29282 |
| PolarSurfaceArea | 78.41 |
| Druglikeness | -6.4661 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | aromatic nitro |
| Shape Index | 0.52632 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 1 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| AcidicOxygens | 1 |
| StereoCon |
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