(E)-2-[(2-hydrazinyl-2-oxoethyl)amino]-2-hydroxyethenediazonium
Formula:C4H8N5O2
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
(E)-2-[(2-hydrazinyl-2-oxoethyl)amino]-2-hydroxyethenediazonium is a drug-like molecule.
| MolName | (E)-2-[(2-hydrazinyl-2-oxoethyl)amino]-2-hydroxyethenediazonium |
| MolecularFormula | C4H8N5O2 |
| Smiles | NNC(CN/C(/O)=C\[N+]#N)=O |
| InChI | InChI=1S/C4H7N5O2/c5-8-2-3(10)7-1-4(11)9-6/h2,5-7,10H,1H2/p+1 |
| InChIK | VLXTXCQIKDSICD-UHFFFAOYSA-O |
| TotalMolweight | 158.141 |
| Molweight | 158.141 |
| MonoisotopicMass | 158.0678 |
| CLogP | -3.1168 |
| CLogS | -1.863 |
| H Acceptors | 7 |
| H Donors | 4 |
| TotalSurfaceArea | 132.08 |
| Relative PSA | 0.72418 |
| PolarSurfaceArea | 115.53 |
| Druglikeness | -6.1869 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | hydrazine |
| Shape Index | 0.81818 |
| Fragments | 1 |
| Non HAtoms | 11 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 3 |
| Sp3Atoms | 3 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - (E)-2-[(2-hydrazinyl-2-oxoethyl)amino]-2-hydroxyethenediazonium | 2 - (E)-2-[(2-hydrazinyl-2-oxoethyl)amino]-2-hydroxyethenediazonium
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