N-cyclohexyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-amine
Formula:C21H23N3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-cyclohexyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-amine is a drug-like molecule.
| MolName | N-cyclohexyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-amine |
| MolecularFormula | C21H23N3 |
| Smiles | C(CC1)CCC1Nc1c(/C=C/c2ccccc2)nc2n1cccc2 |
| InChI | InChI=1S/C21H23N3/c1-3-9-17(10-4-1)14-15-19-21(22-18-11-5-2-6-12-18)24-16-8-7-13-20(24)23-19/h1,3-4,7-10,13-16,18,22H,2,5-6,11-12H2 |
| InChIK | LFIVUVCJOWGMOO-UHFFFAOYSA-N |
| TotalMolweight | 317.435 |
| Molweight | 317.435 |
| MonoisotopicMass | 317.189197 |
| CLogP | 4.4172 |
| CLogS | -7.216 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 262.79 |
| Relative PSA | 0.11561 |
| PolarSurfaceArea | 29.33 |
| Druglikeness | -3.2815 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.54167 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 15 |
| Sp3Atoms | 7 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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