1-(diaminomethylidene)-2-morpholin-4-ylguanidine
Formula:C6H14N6O
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
1-(diaminomethylidene)-2-morpholin-4-ylguanidine is a drug-like molecule.
| MolName | 1-(diaminomethylidene)-2-morpholin-4-ylguanidine |
| MolecularFormula | C6H14N6O |
| Smiles | NC(N)=N/C(/N)=N\N1CCOCC1 |
| InChI | InChI=1S/C6H14N6O/c7-5(8)10-6(9)11-12-1-3-13-4-2-12/h1-4H2,(H6,7,8,9,10,11) |
| InChIK | WNGAJIBLMRTWND-UHFFFAOYSA-N |
| TotalMolweight | 186.218 |
| Molweight | 186.218 |
| MonoisotopicMass | 186.122909 |
| CLogP | -1.8602 |
| CLogS | -1.29 |
| H Acceptors | 7 |
| H Donors | 3 |
| TotalSurfaceArea | 146.84 |
| Relative PSA | 0.56102 |
| PolarSurfaceArea | 115.25 |
| Druglikeness | 2.0885 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.69231 |
| Fragments | 1 |
| Non HAtoms | 13 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3Atoms | 6 |
| Symmetricatoms | 3 |
| BasicNitrogens | 2 |
| StereoCon |
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