3-(2,3-diphenylindol-1-yl)-N-[(E)-(3-hydroxyphenyl)methylideneamino]propanamide
Formula:C30H25N3O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
3-(2,3-diphenylindol-1-yl)-N-[(E)-(3-hydroxyphenyl)methylideneamino]propanamide is not a drug-like molecule.
| MolName | 3-(2,3-diphenylindol-1-yl)-N-[(E)-(3-hydroxyphenyl)methylideneamino]propanamide |
| MolecularFormula | C30H25N3O2 |
| Smiles | Oc1cccc(/C=N/NC(CCn(c2c3cccc2)c(-c2ccccc2)c3-c2ccccc2)=O)c1 |
| InChI | InChI=1S/C30H25N3O2/c34-25-15-9-10-22(20-25)21-31-32-28(35)18-19-33-27-17-8-7-16-26(27)29(23-11-3-1-4-12-23)30(33)24-13-5-2-6-14-24/h1-17,20-21,34H,18-19H2,(H,32,35) |
| InChIK | YSUOYJUUDMSIKP-UHFFFAOYSA-N |
| TotalMolweight | 459.548 |
| Molweight | 459.548 |
| MonoisotopicMass | 459.194677 |
| CLogP | 6.3865 |
| CLogS | -7.214 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 364.18 |
| Relative PSA | 0.15372 |
| PolarSurfaceArea | 66.62 |
| Druglikeness | 6.4572 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.48571 |
| Fragments | 1 |
| Non HAtoms | 35 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 7 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 5 |
| Aromatic Atoms | 27 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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