| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 15th, 2008 | 28 | No |
Popular Name: (5R)-3-amino-2-[(4-benzylpiperazin-1-yl)methyl]-5-phenyl-cyclohex-2-en-1-one (5R)-3-amino-2-[(4-benzylpiperaz…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.92 | 10.65 | -22.52 | 2 | 4 | 0 | 55 | 375.516 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.92 | 8.52 | -39.4 | 1 | 4 | -1 | 53 | 374.508 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.25 | 9.97 | -44.32 | 3 | 4 | 1 | 51 | 376.524 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![[2-[(4-benzylpiperazino)methyl]-5-phenyl-cyclohex-2-en-1-ylidene]amine](http://zinc12.docking.org/img/rings/96074.gif)