(Z)-2-amino-3-(fluoren-9-ylideneamino)but-2-enedinitrile
Formula:C17H10N4
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
(Z)-2-amino-3-(fluoren-9-ylideneamino)but-2-enedinitrile is a drug-like molecule.
| MolName | (Z)-2-amino-3-(fluoren-9-ylideneamino)but-2-enedinitrile |
| MolecularFormula | C17H10N4 |
| Smiles | N/C(/C#N)=C(/C#N)\N=C1c(cccc2)c2-c2c1cccc2 |
| InChI | InChI=1S/C17H10N4/c18-9-15(20)16(10-19)21-17-13-7-3-1-5-11(13)12-6-2-4-8-14(12)17/h1-8H,20H2 |
| InChIK | BFUGWABVNQQRCX-UHFFFAOYSA-N |
| TotalMolweight | 270.294 |
| Molweight | 270.294 |
| MonoisotopicMass | 270.090546 |
| CLogP | 3.0519 |
| CLogS | -6.125 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 217.35 |
| Relative PSA | 0.24799 |
| PolarSurfaceArea | 85.96 |
| Druglikeness | -5.7233 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.47619 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 1 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 6 |
| BasicNitrogens | 1 |
| StereoCon |
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