| MolName | (1S)-1-(3-hydroxyphenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione |
| MolecularFormula | C22H14N2O4 |
| Smiles | Oc1cccc([C@@H](C2=C(C3=O)Oc(cccc4)c4C2=O)N3c2ncccc2)c1 |
| InChI | InChI=1S/C22H14N2O4/c25-14-7-5-6-13(12-14)19-18-20(26)15-8-1-2-9-16(15)28-21(18)22(27)24(19)17-10-3-4-11-23-17/h1-12,19,25H/t19-/m0/s1 |
| InChIK | MAMKLLKTURPWDI-IBGZPJMESA-N |
| TotalMolweight | 370.363 |
| Molweight | 370.363 |
| MonoisotopicMass | 370.095358 |
| CLogP | 2.9626 |
| CLogS | -4.362 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 262.11 |
| Relative PSA | 0.24303 |
| PolarSurfaceArea | 79.73 |
| Druglikeness | 2.6781 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.39286 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| StereoCenters | 1 |
| Rotatable Bond | 2 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon | this enantiomer |
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1 - (1S)-1-(3-hydroxyphenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione | 2 - (1S)-1-(3-hydroxyphenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione