| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 24 | Yes |
Popular Name: [(3S)-3-(3,4-dimethoxyphenyl)-4-methyl-piperazin-1-yl]-(2-thienyl)methanone [(3S)-3-(3,4-dimethoxyphenyl)-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) | 2.40 | 5.92 | -10.65 | 0 | 5 | 0 | 42 | 346.452 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.40 | 7.92 | -49.43 | 1 | 5 | 1 | 43 | 347.46 | 4 | ↓ |
