| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2010 | 22 | Yes |
Popular Name: 4-(1,3-benzodioxol-5-ylmethyl)-N-isopropyl-piperazine-1-carboxamide 4-(1,3-benzodioxol-5-ylmethyl)-N…
| 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) | 2.40 | 4.1 | -13.21 | 1 | 6 | 0 | 54 | 305.378 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.40 | 6.32 | -51.43 | 2 | 6 | 1 | 55 | 306.386 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
