In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 20 | Yes |
Popular Name: 1-[(2,4-dimethoxyphenyl)methyl]-4-isopropyl-piperazine 1-[(2,4-dimethoxyphenyl)methyl]-…
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) | 2.35 | 5.81 | -33.5 | 1 | 4 | 1 | 26 | 279.404 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.35 | 3.54 | -4.77 | 0 | 4 | 0 | 25 | 278.396 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.35 | 5.86 | -33.86 | 1 | 4 | 1 | 26 | 279.404 | 5 | ↓ |