N'-(6,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide
Formula:C18H19N3O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(6,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide is a drug-like molecule.
| MolName | N'-(6,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide |
| MolecularFormula | C18H19N3O |
| Smiles | Cc(c(C)c1)cc2c1C(NNC(c1cnccc1)=O)=CCC2 |
| InChI | InChI=1S/C18H19N3O/c1-12-9-14-5-3-7-17(16(14)10-13(12)2)20-21-18(22)15-6-4-8-19-11-15/h4,6-11,20H,3,5H2,1-2H3,(H,21,22) |
| InChIK | VDAPPLLBUNUXSF-UHFFFAOYSA-N |
| TotalMolweight | 293.369 |
| Molweight | 293.369 |
| MonoisotopicMass | 293.152812 |
| CLogP | 2.4302 |
| CLogS | -3.95 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 235.7 |
| Relative PSA | 0.19911 |
| PolarSurfaceArea | 54.02 |
| Druglikeness | 0.079048 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.59091 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 5 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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