(NZ)-N-[[2,4-diamino-5-[(Z)-hydroxyiminomethyl]phenyl]methylidene]hydroxylamine
Formula:C8H10N4O2
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[[2,4-diamino-5-[(Z)-hydroxyiminomethyl]phenyl]methylidene]hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-[[2,4-diamino-5-[(Z)-hydroxyiminomethyl]phenyl]methylidene]hydroxylamine |
| MolecularFormula | C8H10N4O2 |
| Smiles | Nc1cc(N)c(/C=N\O)cc1/C=N\O |
| InChI | InChI=1S/C8H10N4O2/c9-7-2-8(10)6(4-12-14)1-5(7)3-11-13/h1-4,13-14H,9-10H2 |
| InChIK | RJURIDPZDCLOCZ-UHFFFAOYSA-N |
| TotalMolweight | 194.193 |
| Molweight | 194.193 |
| MonoisotopicMass | 194.080376 |
| CLogP | 1.4144 |
| CLogS | -3.166 |
| H Acceptors | 6 |
| H Donors | 4 |
| TotalSurfaceArea | 152.52 |
| Relative PSA | 0.52295 |
| PolarSurfaceArea | 117.22 |
| Druglikeness | -0.97823 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | 1,3-diamino-aryl |
| Shape Index | 0.64286 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 2 |
| Symmetricatoms | 6 |
| Amines | 2 |
| Aromatic Amines | 2 |
| StereoCon |
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1 - (NZ)-N-[[2,4-diamino-5-[(Z)-hydroxyiminomethyl]phenyl]methylidene]hydroxylamine | 2 - (NZ)-N-[[2,4-diamino-5-[(Z)-hydroxyiminomethyl]phenyl]methylidene]hydroxylamine
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