In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 31 | Yes |
Popular Name: 1-[(3-ethoxy-4-methoxy-phenyl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine 1-[(3-ethoxy-4-methoxy-phenyl)me…
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) | 2.88 | 9.43 | -50.68 | 1 | 7 | 1 | 54 | 431.553 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.88 | 8.82 | -44.24 | 1 | 7 | 1 | 54 | 431.553 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.88 | 7.05 | -10.59 | 0 | 7 | 0 | 53 | 430.545 | 10 | ↓ |