In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 24th, 2011 | 26 | Yes |
Popular Name: 2-(3-chlorophenyl)-1-[(2S)-4-[(3-methoxyphenyl)methyl]-2-methyl-piperazin-1-yl]ethanone 2-(3-chlorophenyl)-1-[(2S)-4-[(3…
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) | 3.77 | 8.99 | -10.15 | 0 | 4 | 0 | 33 | 372.896 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.77 | 11.22 | -50.36 | 1 | 4 | 1 | 34 | 373.904 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.