In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 21 | Yes |
Popular Name: 1-[(2-methoxyphenyl)methyl]-4-[[(2S)-pyrrolidin-2-yl]methyl]piperazine 1-[(2-methoxyphenyl)methyl]-4-[[…
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) | 1.82 | 6.6 | -91.46 | 3 | 4 | 2 | 34 | 291.439 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.82 | 6.82 | -117.92 | 3 | 4 | 2 | 34 | 291.439 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.82 | 4.29 | -36.46 | 2 | 4 | 1 | 32 | 290.431 | 5 | ↓ |