In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 31 | Yes |
Popular Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[(3,4-dimethoxyphenyl)methyl]acetamide 2-[4-(1,3-benzodioxol-5-ylmethyl…
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) | 2.17 | 6 | -49.44 | 2 | 8 | 1 | 74 | 428.509 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.17 | 3.76 | -15.49 | 1 | 8 | 0 | 73 | 427.501 | 8 | ↓ |