| MolName | [(Z)-[4-(piperidine-1-carbonyl)fluoren-9-ylidene]amino]urea |
| MolecularFormula | C20H20N4O2 |
| Smiles | NC(N/N=C(/c1c-2cccc1)\c1c2c(C(N2CCCCC2)=O)ccc1)=O |
| InChI | InChI=1S/C20H20N4O2/c21-20(26)23-22-18-14-8-3-2-7-13(14)17-15(18)9-6-10-16(17)19(25)24-11-4-1-5-12-24/h2-3,6-10H,1,4-5,11-12H2,(H3,21,23,26) |
| InChIK | QSTWZWAPESODOX-UHFFFAOYSA-N |
| TotalMolweight | 348.405 |
| Molweight | 348.405 |
| MonoisotopicMass | 348.158626 |
| CLogP | 3.5566 |
| CLogS | -6.189 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 263.57 |
| Relative PSA | 0.2575 |
| PolarSurfaceArea | 87.79 |
| Druglikeness | 4.1914 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 2 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 5 |
| Symmetricatoms | 2 |
| Amides | 2 |
| StereoCon |
Click to Load Molecule:
1 - [(Z)-[4-(piperidine-1-carbonyl)fluoren-9-ylidene]amino]urea | 2 - [(Z)-[4-(piperidine-1-carbonyl)fluoren-9-ylidene]amino]urea