(NZ)-N-[[10-(4-chlorophenyl)sulfanylanthracen-9-yl]methylidene]hydroxylamine
Formula:C21H14NOClS
Mutagenic:low
Tumorigenic:high
Reproductive Effective:none
(NZ)-N-[[10-(4-chlorophenyl)sulfanylanthracen-9-yl]methylidene]hydroxylamine is not a drug-like molecule.
| MolName | (NZ)-N-[[10-(4-chlorophenyl)sulfanylanthracen-9-yl]methylidene]hydroxylamine |
| MolecularFormula | C21H14NOClS |
| Smiles | O/N=C\c(c1ccccc11)c(cccc2)c2c1Sc(cc1)ccc1Cl |
| InChI | InChI=1S/C21H14ClNOS/c22-14-9-11-15(12-10-14)25-21-18-7-3-1-5-16(18)20(13-23-24)17-6-2-4-8-19(17)21/h1-13,24H |
| InChIK | VKEYKODBXUIELT-UHFFFAOYSA-N |
| TotalMolweight | 363.867 |
| Molweight | 363.867 |
| MonoisotopicMass | 363.048461 |
| CLogP | 7.0302 |
| CLogS | -8.049 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 266.24 |
| Relative PSA | 0.15813 |
| PolarSurfaceArea | 57.89 |
| Druglikeness | -0.27479 |
| Mutagenic | low |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | high |
| Nasty Functions | |
| Shape Index | 0.52 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 3 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 20 |
| Sp3Atoms | 2 |
| Symmetricatoms | 8 |
| StereoCon |
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