N-[(Z)-anthracen-9-ylmethylideneamino]-7-chloroquinolin-4-amine
Formula:C24H16N3Cl
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
N-[(Z)-anthracen-9-ylmethylideneamino]-7-chloroquinolin-4-amine is not a drug-like molecule.
| MolName | N-[(Z)-anthracen-9-ylmethylideneamino]-7-chloroquinolin-4-amine |
| MolecularFormula | C24H16N3Cl |
| Smiles | Clc1cc2nccc(N/N=C\c3c(cccc4)c4cc4ccccc34)c2cc1 |
| InChI | InChI=1S/C24H16ClN3/c25-18-9-10-21-23(11-12-26-24(21)14-18)28-27-15-22-19-7-3-1-5-16(19)13-17-6-2-4-8-20(17)22/h1-15H,(H,26,28) |
| InChIK | GPCWEKICQHIVGX-UHFFFAOYSA-N |
| TotalMolweight | 381.865 |
| Molweight | 381.865 |
| MonoisotopicMass | 381.103274 |
| CLogP | 8.1517 |
| CLogS | -7.803 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 287.22 |
| Relative PSA | 0.11817 |
| PolarSurfaceArea | 37.28 |
| Druglikeness | 2.3845 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | high |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 3 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 5 |
| Aromatic Atoms | 24 |
| Symmetricatoms | 6 |
| Aromatic Nitrogens | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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