7-hydroxy-3-quinolin-2-ylchromen-4-one
Formula:C18H11NO3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
7-hydroxy-3-quinolin-2-ylchromen-4-one is a drug-like molecule.
| MolName | 7-hydroxy-3-quinolin-2-ylchromen-4-one |
| MolecularFormula | C18H11NO3 |
| Smiles | Oc(cc1)cc(OC=C2c3nc4ccccc4cc3)c1C2=O |
| InChI | InChI=1S/C18H11NO3/c20-12-6-7-13-17(9-12)22-10-14(18(13)21)16-8-5-11-3-1-2-4-15(11)19-16/h1-10,20H |
| InChIK | ZHLCBXGOOIALKS-UHFFFAOYSA-N |
| TotalMolweight | 289.289 |
| Molweight | 289.289 |
| MonoisotopicMass | 289.073894 |
| CLogP | 2.6886 |
| CLogS | -4.049 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 211.69 |
| Relative PSA | 0.22254 |
| PolarSurfaceArea | 59.42 |
| Druglikeness | 0.088711 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.59091 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 1 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Sp3Atoms | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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