(2Z,14Z)-25,26,27,28-tetraoxapentacyclo[20.2.1.14,7.110,13.116,19]octacosa-1(24),2,4,6,10,12,14,16,18,22-decaen-8,20-diyne
Formula:C24H12O4
Mutagenic:low
Tumorigenic:high
Reproductive Effective:none
(2Z,14Z)-25,26,27,28-tetraoxapentacyclo[20.2.1.14,7.110,13.116,19]octacosa-1(24),2,4,6,10,12,14,16,18,22-decaen-8,20-diyne is not a drug-like molecule.
| MolName | (2Z,14Z)-25,26,27,28-tetraoxapentacyclo[20.2.1.14,7.110,13.116,19]octacosa-1(24),2,4,6,10,12,14,16,18,22-decaen-8,20-diyne |
| MolecularFormula | C24H12O4 |
| Smiles | c1c(/C=C\c2ccc(C#Cc3ccc(/C=C\c4ccc(C#C5)o4)o3)o2)oc5c1 |
| InChI | InChI=1S/C24H12O4/c1-2-18-11-12-20-5-6-22(27-20)15-16-24-8-7-23(28-24)14-13-21-4-3-19(26-21)10-9-17(1)25-18/h1-10,15-16H |
| InChIK | MSCPURIWFFEGPL-UHFFFAOYSA-N |
| TotalMolweight | 364.355 |
| Molweight | 364.355 |
| MonoisotopicMass | 364.07356 |
| CLogP | 5.7528 |
| CLogS | -5.698 |
| H Acceptors | 4 |
| TotalSurfaceArea | 310.4 |
| Relative PSA | 0.18183 |
| PolarSurfaceArea | 52.56 |
| Druglikeness | -3.2425 |
| Mutagenic | low |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.42857 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rings Closures | 5 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 20 |
| Symmetricatoms | 21 |
| StereoCon |
Click to Load Molecule:
1 - (2Z,14Z)-25,26,27,28-tetraoxapentacyclo[20.2.1.14,7.110,13.116,19]octacosa-1(24),2,4,6,10,12,14,16,18,22-decaen-8,20-diyne | 2 - (2Z,14Z)-25,26,27,28-tetraoxapentacyclo[20.2.1.14,7.110,13.116,19]octacosa-1(24),2,4,6,10,12,14,16,18,22-decaen-8,20-diyne
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