6-chloro-N-cyclohexyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-amine
Formula:C21H22N3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
6-chloro-N-cyclohexyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-amine is not a drug-like molecule.
| MolName | 6-chloro-N-cyclohexyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-amine |
| MolecularFormula | C21H22N3Cl |
| Smiles | Clc1cn2c(NC3CCCCC3)c(/C=C/c3ccccc3)nc2cc1 |
| InChI | InChI=1S/C21H22ClN3/c22-17-12-14-20-24-19(13-11-16-7-3-1-4-8-16)21(25(20)15-17)23-18-9-5-2-6-10-18/h1,3-4,7-8,11-15,18,23H,2,5-6,9-10H2 |
| InChIK | WLXKYKUNMCMYCZ-UHFFFAOYSA-N |
| TotalMolweight | 351.88 |
| Molweight | 351.88 |
| MonoisotopicMass | 351.150224 |
| CLogP | 5.0232 |
| CLogS | -7.952 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 278.21 |
| Relative PSA | 0.1092 |
| PolarSurfaceArea | 29.33 |
| Druglikeness | -3.3397 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.52 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| 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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1 - 6-chloro-N-cyclohexyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-amine | 2 - 6-chloro-N-cyclohexyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-amine
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