(E)-5-thia-2,7,13-triazatricyclo[7.4.0.02,6]trideca-1(9),3,6,10,12-pentaen-8-ylidenehydrazine
Formula:C9H7N5S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-5-thia-2,7,13-triazatricyclo[7.4.0.02,6]trideca-1(9),3,6,10,12-pentaen-8-ylidenehydrazine is a drug-like molecule.
| MolName | (E)-5-thia-2,7,13-triazatricyclo[7.4.0.02,6]trideca-1(9),3,6,10,12-pentaen-8-ylidenehydrazine |
| MolecularFormula | C9H7N5S |
| Smiles | N/N=C1/N=C2SC=CN2c2c1cccn2 |
| InChI | InChI=1S/C9H7N5S/c10-13-7-6-2-1-3-11-8(6)14-4-5-15-9(14)12-7/h1-5H,10H2 |
| InChIK | YEIDQWYNVQUEKY-UHFFFAOYSA-N |
| TotalMolweight | 217.256 |
| Molweight | 217.256 |
| MonoisotopicMass | 217.042215 |
| CLogP | 0.7738 |
| CLogS | -3.823 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 153.77 |
| Relative PSA | 0.45718 |
| PolarSurfaceArea | 92.17 |
| Druglikeness | -0.58359 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.46667 |
| Fragments | 1 |
| Non HAtoms | 15 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 2 |
| Aromatic Nitrogens | 1 |
| BasicNitrogens | 2 |
| StereoCon |
Click to Load Molecule:
1 - (E)-5-thia-2,7,13-triazatricyclo[7.4.0.02,6]trideca-1(9),3,6,10,12-pentaen-8-ylidenehydrazine | 2 - (E)-5-thia-2,7,13-triazatricyclo[7.4.0.02,6]trideca-1(9),3,6,10,12-pentaen-8-ylidenehydrazine
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