(2S)-2-phenylcyclopropan-1-amine
Formula:C9H11N
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(2S)-2-phenylcyclopropan-1-amine is a drug-like molecule.
| MolName | (2S)-2-phenylcyclopropan-1-amine |
| MolecularFormula | C9H11N |
| Smiles | NC(C1)[C@@H]1c1ccccc1 |
| InChI | InChI=1S/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8-,9?/m1/s1 |
| InChIK | AELCINSCMGFISI-VEDVMXKPSA-N |
| TotalMolweight | 133.193 |
| Molweight | 133.193 |
| MonoisotopicMass | 133.089149 |
| CLogP | 1.5205 |
| CLogS | -2.25 |
| H Acceptors | 1 |
| H Donors | 1 |
| TotalSurfaceArea | 107.04 |
| Relative PSA | 0.14266 |
| PolarSurfaceArea | 26.02 |
| Druglikeness | -0.5087 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.7 |
| Fragments | 1 |
| Non HAtoms | 10 |
| NonCHAtoms | 1 |
| Electronegative Atoms | 1 |
| StereoCenters | 2 |
| Rotatable Bond | 1 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 4 |
| Symmetricatoms | 2 |
| Amines | 1 |
| AlkylAmines | 1 |
| BasicNitrogens | 1 |
| StereoCon | unknown chirality |
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