(3Z)-3-(indol-1-ylmethylidene)indole
Formula:C17H12N2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(3Z)-3-(indol-1-ylmethylidene)indole is a drug-like molecule.
| MolName | (3Z)-3-(indol-1-ylmethylidene)indole |
| MolecularFormula | C17H12N2 |
| Smiles | C(n(cc1)c2c1cccc2)=C1/c(cccc2)c2N=C1 |
| InChI | InChI=1S/C17H12N2/c1-4-8-17-13(5-1)9-10-19(17)12-14-11-18-16-7-3-2-6-15(14)16/h1-12H |
| InChIK | CFVHFCLEWCMGJE-UHFFFAOYSA-N |
| TotalMolweight | 244.296 |
| Molweight | 244.296 |
| MonoisotopicMass | 244.100048 |
| CLogP | 2.5937 |
| CLogS | -3.204 |
| H Acceptors | 2 |
| TotalSurfaceArea | 192.79 |
| Relative PSA | 0.095337 |
| PolarSurfaceArea | 17.29 |
| Druglikeness | 1.2522 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57895 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bond | 1 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 15 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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