(2R)-1-amino-3-naphthalen-1-yloxypropan-2-ol
Formula:C13H15NO2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(2R)-1-amino-3-naphthalen-1-yloxypropan-2-ol is a drug-like molecule.
| MolName | (2R)-1-amino-3-naphthalen-1-yloxypropan-2-ol |
| MolecularFormula | C13H15NO2 |
| Smiles | NC[C@H](COc1cccc2ccccc12)O |
| InChI | InChI=1S/C13H15NO2/c14-8-11(15)9-16-13-7-3-5-10-4-1-2-6-12(10)13/h1-7,11,15H,8-9,14H2/t11-/m1/s1 |
| InChIK | ZFMCITCRZXLMDJ-LLVKDONJSA-N |
| TotalMolweight | 217.267 |
| Molweight | 217.267 |
| MonoisotopicMass | 217.110279 |
| CLogP | 1.2984 |
| CLogS | -2.98 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 172.75 |
| Relative PSA | 0.22211 |
| PolarSurfaceArea | 55.48 |
| Druglikeness | -0.99366 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.625 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| StereoCenters | 1 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 10 |
| Sp3Atoms | 6 |
| Amines | 1 |
| AlkylAmines | 1 |
| BasicNitrogens | 1 |
| StereoCon | this enantiomer |
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