N-[(Z)-furan-2-ylmethylideneamino]-6-morpholin-4-ylpyrimidin-4-amine
Formula:C13H15N5O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-furan-2-ylmethylideneamino]-6-morpholin-4-ylpyrimidin-4-amine is a drug-like molecule.
| MolName | N-[(Z)-furan-2-ylmethylideneamino]-6-morpholin-4-ylpyrimidin-4-amine |
| MolecularFormula | C13H15N5O2 |
| Smiles | C(COCC1)N1c1ncnc(N/N=C\c2ccco2)c1 |
| InChI | InChI=1S/C13H15N5O2/c1-2-11(20-5-1)9-16-17-12-8-13(15-10-14-12)18-3-6-19-7-4-18/h1-2,5,8-10H,3-4,6-7H2,(H,14,15,17) |
| InChIK | AFLWZDLOGWBHJT-UHFFFAOYSA-N |
| TotalMolweight | 273.295 |
| Molweight | 273.295 |
| MonoisotopicMass | 273.122575 |
| CLogP | 2.8382 |
| CLogS | -2.98 |
| H Acceptors | 7 |
| H Donors | 1 |
| TotalSurfaceArea | 218.29 |
| Relative PSA | 0.33245 |
| PolarSurfaceArea | 75.78 |
| Druglikeness | 3.0933 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.65 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 5 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 2 |
| StereoCon |
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