N-[(Z)-2,3-dihydroinden-1-ylideneamino]-4,5-dihydro-1H-imidazol-2-amine
Formula:C12H14N4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-2,3-dihydroinden-1-ylideneamino]-4,5-dihydro-1H-imidazol-2-amine is a drug-like molecule.
| MolName | N-[(Z)-2,3-dihydroinden-1-ylideneamino]-4,5-dihydro-1H-imidazol-2-amine |
| MolecularFormula | C12H14N4 |
| Smiles | C(C1)c(cccc2)c2/C1=N\NC1=NCCN1 |
| InChI | InChI=1S/C12H14N4/c1-2-4-10-9(3-1)5-6-11(10)15-16-12-13-7-8-14-12/h1-4H,5-8H2,(H2,13,14,16) |
| InChIK | FHHGDCBOLMMRRT-UHFFFAOYSA-N |
| TotalMolweight | 214.271 |
| Molweight | 214.271 |
| MonoisotopicMass | 214.121846 |
| CLogP | 1.7445 |
| CLogS | -3.611 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 170.16 |
| Relative PSA | 0.26998 |
| PolarSurfaceArea | 48.78 |
| Druglikeness | 3.8961 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.625 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 1 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 4 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - N-[(Z)-2,3-dihydroinden-1-ylideneamino]-4,5-dihydro-1H-imidazol-2-amine | 2 - N-[(Z)-2,3-dihydroinden-1-ylideneamino]-4,5-dihydro-1H-imidazol-2-amine
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