(2R)-1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol
Formula:C24H26N4O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(2R)-1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol is a drug-like molecule.
| MolName | (2R)-1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol |
| MolecularFormula | C24H26N4O |
| Smiles | O[C@@H](Cn1c(cccc2)c2c2c1cccc2)CN(CC1)CCN1c1ncccc1 |
| InChI | InChI=1S/C24H26N4O/c29-19(17-26-13-15-27(16-14-26)24-11-5-6-12-25-24)18-28-22-9-3-1-7-20(22)21-8-2-4-10-23(21)28/h1-12,19,29H,13-18H2/t19-/m1/s1 |
| InChIK | VXQCFYVSUXZUTE-LJQANCHMSA-N |
| TotalMolweight | 386.497 |
| Molweight | 386.497 |
| MonoisotopicMass | 386.210661 |
| CLogP | 3.0549 |
| CLogS | -3.448 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 298.69 |
| Relative PSA | 0.12736 |
| PolarSurfaceArea | 44.53 |
| Druglikeness | 6.7159 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.55172 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| StereoCenters | 1 |
| Rotatable Bond | 5 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 19 |
| Sp3Atoms | 9 |
| Symmetricatoms | 8 |
| Amines | 1 |
| AlkylAmines | 1 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 2 |
| StereoCon | this enantiomer |
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