(2E)-2-(carbamoylhydrazinylidene)chromene-3-carboxamide
Formula:C11H10N4O3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:low
(2E)-2-(carbamoylhydrazinylidene)chromene-3-carboxamide is a drug-like molecule.
| MolName | (2E)-2-(carbamoylhydrazinylidene)chromene-3-carboxamide |
| MolecularFormula | C11H10N4O3 |
| Smiles | NC(C1=Cc(cccc2)c2O/C1=N/NC(N)=O)=O |
| InChI | InChI=1S/C11H10N4O3/c12-9(16)7-5-6-3-1-2-4-8(6)18-10(7)14-15-11(13)17/h1-5H,(H2,12,16)(H3,13,15,17) |
| InChIK | XJTOXRAOABJRFD-UHFFFAOYSA-N |
| TotalMolweight | 246.225 |
| Molweight | 246.225 |
| MonoisotopicMass | 246.075291 |
| CLogP | -0.1941 |
| CLogS | -2.919 |
| H Acceptors | 7 |
| H Donors | 3 |
| TotalSurfaceArea | 181.44 |
| Relative PSA | 0.49377 |
| PolarSurfaceArea | 119.8 |
| Druglikeness | 4.4863 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | low |
| Irritant | none |
| Nasty Functions | twice activated DB |
| Shape Index | 0.55556 |
| Fragments | 1 |
| Non HAtoms | 18 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 1 |
| Amides | 2 |
| StereoCon |
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