(NZ)-N-[[1-(4-bromophenyl)pyrrol-3-yl]methylidene]hydroxylamine
Formula:C11H9N2OBr
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[[1-(4-bromophenyl)pyrrol-3-yl]methylidene]hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-[[1-(4-bromophenyl)pyrrol-3-yl]methylidene]hydroxylamine |
| MolecularFormula | C11H9N2OBr |
| Smiles | O/N=C\c(cc1)cn1-c(cc1)ccc1Br |
| InChI | InChI=1S/C11H9BrN2O/c12-10-1-3-11(4-2-10)14-6-5-9(8-14)7-13-15/h1-8,15H |
| InChIK | JOABHPBLGYAXBE-UHFFFAOYSA-N |
| TotalMolweight | 265.109 |
| Molweight | 265.109 |
| MonoisotopicMass | 263.989824 |
| CLogP | 3.1244 |
| CLogS | -5.462 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 171.96 |
| Relative PSA | 0.18307 |
| PolarSurfaceArea | 37.52 |
| Druglikeness | -0.77179 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.73333 |
| Fragments | 1 |
| Non HAtoms | 15 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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