(Z)-N-(4-benzylpiperazin-4-ium-1-yl)-1-(4-phenylphenyl)methanimine
Formula:C24H26N3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(Z)-N-(4-benzylpiperazin-4-ium-1-yl)-1-(4-phenylphenyl)methanimine is a drug-like molecule.
| MolName | (Z)-N-(4-benzylpiperazin-4-ium-1-yl)-1-(4-phenylphenyl)methanimine |
| MolecularFormula | C24H26N3 |
| Smiles | C(c1ccccc1)[NH+](CC1)CCN1/N=C\c(cc1)ccc1-c1ccccc1 |
| InChI | InChI=1S/C24H25N3/c1-3-7-22(8-4-1)20-26-15-17-27(18-16-26)25-19-21-11-13-24(14-12-21)23-9-5-2-6-10-23/h1-14,19H,15-18,20H2/p+1 |
| InChIK | IXFVKBVTWWQIMO-UHFFFAOYSA-O |
| TotalMolweight | 356.491 |
| Molweight | 356.491 |
| MonoisotopicMass | 356.212672 |
| CLogP | 2.5685 |
| CLogS | -4.742 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 307.48 |
| Relative PSA | 0.10619 |
| PolarSurfaceArea | 20.04 |
| Druglikeness | 3.8498 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.7037 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 7 |
| Symmetricatoms | 8 |
| Amines | 1 |
| AlkylAmines | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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