[(Z)-(2,2-diphenylcycloheptylidene)amino]urea
Formula:C20H23N3O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(Z)-(2,2-diphenylcycloheptylidene)amino]urea is a drug-like molecule.
| MolName | [(Z)-(2,2-diphenylcycloheptylidene)amino]urea |
| MolecularFormula | C20H23N3O |
| Smiles | NC(N/N=C(/CCCCC1)\C1(c1ccccc1)c1ccccc1)=O |
| InChI | InChI=1S/C20H23N3O/c21-19(24)23-22-18-14-8-3-9-15-20(18,16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-2,4-7,10-13H,3,8-9,14-15H2,(H3,21,23,24) |
| InChIK | CLRRENORYURKNF-UHFFFAOYSA-N |
| TotalMolweight | 321.423 |
| Molweight | 321.423 |
| MonoisotopicMass | 321.184112 |
| CLogP | 3.9599 |
| CLogS | -4.581 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 259.43 |
| Relative PSA | 0.19766 |
| PolarSurfaceArea | 67.48 |
| Druglikeness | -1.7223 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.41667 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 8 |
| Amides | 1 |
| StereoCon |
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