In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2009 | 19 | Yes |
Popular Name: (2S)-2-(1,3-benzodioxol-5-yl)-2-piperazin-1-yl-propan-1-ol (2S)-2-(1,3-benzodioxol-5-yl)-2-…
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) | 0.93 | 0.42 | -45.08 | 3 | 5 | 1 | 59 | 265.333 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.