| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 6th, 2011 | 40 | No |
Popular Name: [3-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]phenyl]-chloro-methyl-BLAHone [3-[4-(1,3-benzodioxol-5-ylmethy…
| 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) | 3.57 | 8.59 | -24.32 | 1 | 9 | 0 | 84 | 561.038 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | 10.8 | -52.16 | 2 | 9 | 1 | 85 | 562.046 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![[3-(4-piperonylpiperazine-1-carbonyl)phenyl]BLAHone](http://zinc12.docking.org/img/rings/195492.gif)