(E)-(diaminomethylideneamino)-[(2,3-dichlorophenyl)methylidene]azanium
Formula:C8H9N4Cl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-(diaminomethylideneamino)-[(2,3-dichlorophenyl)methylidene]azanium is a drug-like molecule.
| MolName | (E)-(diaminomethylideneamino)-[(2,3-dichlorophenyl)methylidene]azanium |
| MolecularFormula | C8H9N4Cl2 |
| Smiles | NC(N)=N/[NH+]=C/c1cccc(Cl)c1Cl |
| InChI | InChI=1S/C8H8Cl2N4/c9-6-3-1-2-5(7(6)10)4-13-14-8(11)12/h1-4H,(H4,11,12,14)/p+1 |
| InChIK | WLTSTDGGFCQWTK-UHFFFAOYSA-O |
| TotalMolweight | 232.093 |
| Molweight | 232.093 |
| MonoisotopicMass | 231.020425 |
| CLogP | 2.4688 |
| CLogS | -4.462 |
| H Acceptors | 4 |
| H Donors | 3 |
| TotalSurfaceArea | 157.36 |
| Relative PSA | 0.26722 |
| PolarSurfaceArea | 78.37 |
| Druglikeness | -1.5899 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| 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 |
| Symmetricatoms | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - (E)-(diaminomethylideneamino)-[(2,3-dichlorophenyl)methylidene]azanium | 2 - (E)-(diaminomethylideneamino)-[(2,3-dichlorophenyl)methylidene]azanium
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