(NZ)-N-[[3-(4-cyclohexylphenyl)-1-phenylpyrazol-4-yl]methylidene]hydroxylamine
Formula:C22H23N3O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[[3-(4-cyclohexylphenyl)-1-phenylpyrazol-4-yl]methylidene]hydroxylamine is not a drug-like molecule.
| MolName | (NZ)-N-[[3-(4-cyclohexylphenyl)-1-phenylpyrazol-4-yl]methylidene]hydroxylamine |
| MolecularFormula | C22H23N3O |
| Smiles | O/N=C\c1cn(-c2ccccc2)nc1-c1ccc(C2CCCCC2)cc1 |
| InChI | InChI=1S/C22H23N3O/c26-23-15-20-16-25(21-9-5-2-6-10-21)24-22(20)19-13-11-18(12-14-19)17-7-3-1-4-8-17/h2,5-6,9-17,26H,1,3-4,7-8H2 |
| InChIK | FHDWSVQSQBYXJC-UHFFFAOYSA-N |
| TotalMolweight | 345.445 |
| Molweight | 345.445 |
| MonoisotopicMass | 345.184112 |
| CLogP | 5.2701 |
| CLogS | -5.595 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 279.65 |
| Relative PSA | 0.1518 |
| PolarSurfaceArea | 50.41 |
| Druglikeness | -2.0869 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57692 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 7 |
| Symmetricatoms | 6 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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