N-[2-[(2Z)-2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]imidazole-1-carboxamide
Formula:C11H11N5O3
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
N-[2-[(2Z)-2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]imidazole-1-carboxamide is a drug-like molecule.
| MolName | N-[2-[(2Z)-2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]imidazole-1-carboxamide |
| MolecularFormula | C11H11N5O3 |
| Smiles | O=C(CNC(n1cncc1)=O)N/N=C\c1ccco1 |
| InChI | InChI=1S/C11H11N5O3/c17-10(15-14-6-9-2-1-5-19-9)7-13-11(18)16-4-3-12-8-16/h1-6,8H,7H2,(H,13,18)(H,15,17) |
| InChIK | XUVVERMFEUMONM-UHFFFAOYSA-N |
| TotalMolweight | 261.24 |
| Molweight | 261.24 |
| MonoisotopicMass | 261.08619 |
| CLogP | 0.1689 |
| CLogS | -2.278 |
| H Acceptors | 8 |
| H Donors | 2 |
| TotalSurfaceArea | 207.61 |
| Relative PSA | 0.44535 |
| PolarSurfaceArea | 101.52 |
| Druglikeness | 7.008 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.68421 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 10 |
| Sp3Atoms | 1 |
| Amides | 1 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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