| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 10th, 2011 | 19 | Yes |
Popular Name: 1,3-benzodioxol-5-yl-[(3S)-3-ethylpiperazin-1-yl]methanone 1,3-benzodioxol-5-yl-[(3S)-3-eth…
| 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) | 1.31 | 4.18 | -50.03 | 2 | 5 | 1 | 55 | 263.317 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.31 | 3.08 | -10.49 | 1 | 5 | 0 | 51 | 262.309 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
