2-[(2R)-pyrrolidin-2-yl]acetic acid
Formula:C6H11NO2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[(2R)-pyrrolidin-2-yl]acetic acid is a drug-like molecule.
| MolName | 2-[(2R)-pyrrolidin-2-yl]acetic acid |
| MolecularFormula | C6H11NO2 |
| Smiles | OC(C[C@@H]1NCCC1)=O |
| InChI | InChI=1S/C6H11NO2/c8-6(9)4-5-2-1-3-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m1/s1 |
| InChIK | ADSALMJPJUKESW-RXMQYKEDSA-N |
| TotalMolweight | 129.158 |
| Molweight | 129.158 |
| MonoisotopicMass | 129.078979 |
| CLogP | -2.1581 |
| CLogS | -0.978 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 103.1 |
| Relative PSA | 0.36469 |
| PolarSurfaceArea | 49.33 |
| Druglikeness | -2.0575 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 9 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| StereoCenters | 1 |
| Rotatable Bond | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3Atoms | 7 |
| Amines | 1 |
| AlkylAmines | 1 |
| BasicNitrogens | 1 |
| AcidicOxygens | 1 |
| StereoCon | this enantiomer |
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