Mol Weight - 192.261
Smiles - COc(cc1)ccc1N1CCNCC1.Br
| Property Name | Property Value |
| Mol Name | 1-(4-Methoxy Phenyl) Piperazine Hbr |
| Molweight | 192.261 |
| Monoisotopic Mass | 192.126263 |
| Clogp | 1.1151 |
| Clogs | -1.601 |
| H Acceptors | 3 |
| H Donors | 1 |
| Total Surface Area | 158.82 |
| Relative Psa | 0.15747 |
| Polar Surface Area | 24.5 |
| Druglikeness | 2.6335 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.71429 |
| Molecular Flexibility | 0.38447 |
| Molecular Complexity | 0.56169 |
| Fragments | 2 |
| Non H Atoms | 14 |
| Non Ch Atoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bonds | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3 Atoms | 7 |
| Symmetric Atoms | 4 |
| Amines | 2 |
| Alkyl Amines | 1 |
| Aromatic Amines | 1 |
| Basic Nitrogens | 1 |
| Smiles | COc(cc1)ccc1N1CCNCC1.Br |
| InChIKey | InChI=1S/C11H16N2O.BrH/c1-14-11-4-2-10(3-5-11)13-8-6-12-7-9-13;/h2-5,12H,6-9H2,1H3;1H |
| InChI | CIINIXAOAQOZHF-UHFFFAOYSA-N |
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1 — 1-(4-Methoxy Phenyl) Piperazine Hbr | 2 — 1-(4-Methoxy Phenyl) Piperazine Hbr