[(E)-2-bicyclo[3.3.1]nonanylideneamino]urea
Formula:C10H17N3O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(E)-2-bicyclo[3.3.1]nonanylideneamino]urea is a drug-like molecule.
| MolName | [(E)-2-bicyclo[3.3.1]nonanylideneamino]urea |
| MolecularFormula | C10H17N3O |
| Smiles | NC(N/N=C1/C(CCC2)CC2CC1)=O |
| InChI | InChI=1S/C10H17N3O/c11-10(14)13-12-9-5-4-7-2-1-3-8(9)6-7/h7-8H,1-6H2,(H3,11,13,14) |
| InChIK | RGGLASWWZWZVPR-UHFFFAOYSA-N |
| TotalMolweight | 195.265 |
| Molweight | 195.265 |
| MonoisotopicMass | 195.137162 |
| CLogP | 1.4734 |
| CLogS | -3.352 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 154.76 |
| Relative PSA | 0.33135 |
| PolarSurfaceArea | 67.48 |
| Druglikeness | 0.60768 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.64286 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| StereoCenters | 2 |
| Rotatable Bond | 1 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Sp3Atoms | 8 |
| Amides | 1 |
| StereoCon | unknown chirality |
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1 - [(E)-2-bicyclo[3.3.1]nonanylideneamino]urea | 2 - [(E)-2-bicyclo[3.3.1]nonanylideneamino]urea
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