N-[(Z)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide
Formula:C14H10N5OCl
Mutagenic:none
Tumorigenic:high
Reproductive Effective:high
N-[(Z)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide is a drug-like molecule.
| MolName | N-[(Z)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide |
| MolecularFormula | C14H10N5OCl |
| Smiles | O=C(c1ccncc1)N/N=C\c(n(cccc1)c1n1)c1Cl |
| InChI | InChI=1S/C14H10ClN5O/c15-13-11(20-8-2-1-3-12(20)18-13)9-17-19-14(21)10-4-6-16-7-5-10/h1-9H,(H,19,21) |
| InChIK | SNWOLVPTIDFADT-UHFFFAOYSA-N |
| TotalMolweight | 299.72 |
| Molweight | 299.72 |
| MonoisotopicMass | 299.057387 |
| CLogP | 1.9006 |
| CLogS | -4.73 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 225.18 |
| Relative PSA | 0.29265 |
| PolarSurfaceArea | 71.65 |
| Druglikeness | 5.5211 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.61905 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 15 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 3 |
| StereoCon |
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