7-hydroxy-10-oxa-13-azapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1,4(9),5,7,11,14,16,18,20-nonaen-3-one
Formula:C19H11NO3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
7-hydroxy-10-oxa-13-azapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1,4(9),5,7,11,14,16,18,20-nonaen-3-one is a drug-like molecule.
| MolName | 7-hydroxy-10-oxa-13-azapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1,4(9),5,7,11,14,16,18,20-nonaen-3-one |
| MolecularFormula | C19H11NO3 |
| Smiles | Oc(cc1)cc(Oc2cn3c(cccc4)c4ccc3c22)c1C2=O |
| InChI | InChI=1S/C19H11NO3/c21-12-6-7-13-16(9-12)23-17-10-20-14-4-2-1-3-11(14)5-8-15(20)18(17)19(13)22/h1-10,21H |
| InChIK | CMWBNXXONZYRFT-UHFFFAOYSA-N |
| TotalMolweight | 301.3 |
| Molweight | 301.3 |
| MonoisotopicMass | 301.073894 |
| CLogP | 3.9983 |
| CLogS | -7.363 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 213.47 |
| Relative PSA | 0.20654 |
| PolarSurfaceArea | 50.94 |
| Druglikeness | 2.0158 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.52174 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 19 |
| Sp3Atoms | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
Click to Load Molecule:
1 - 7-hydroxy-10-oxa-13-azapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1,4(9),5,7,11,14,16,18,20-nonaen-3-one | 2 - 7-hydroxy-10-oxa-13-azapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1,4(9),5,7,11,14,16,18,20-nonaen-3-one
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