(5S)-5-(2-methylanilino)-1,3-thiazolidine-2,4-dione
Formula:C10H10N2O2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(5S)-5-(2-methylanilino)-1,3-thiazolidine-2,4-dione is a drug-like molecule.
| MolName | (5S)-5-(2-methylanilino)-1,3-thiazolidine-2,4-dione |
| MolecularFormula | C10H10N2O2S |
| Smiles | Cc(cccc1)c1N[C@H](C(N1)=O)SC1=O |
| InChI | InChI=1S/C10H10N2O2S/c1-6-4-2-3-5-7(6)11-9-8(13)12-10(14)15-9/h2-5,9,11H,1H3,(H,12,13,14)/t9-/m0/s1 |
| InChIK | FHDMQTCVTPKBMD-VIFPVBQESA-N |
| TotalMolweight | 222.267 |
| Molweight | 222.267 |
| MonoisotopicMass | 222.046298 |
| CLogP | 1.6694 |
| CLogS | -2.793 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 160.43 |
| Relative PSA | 0.41445 |
| PolarSurfaceArea | 83.5 |
| Druglikeness | 3.1111 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 15 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| StereoCenters | 1 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 3 |
| Amides | 1 |
| StereoCon | this enantiomer |
Click to Load Molecule:
1 - (5S)-5-(2-methylanilino)-1,3-thiazolidine-2,4-dione | 2 - (5S)-5-(2-methylanilino)-1,3-thiazolidine-2,4-dione
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