In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 23 | Yes |
Popular Name: 1-[(3S)-3-(3,4-dimethoxyphenyl)-4-methyl-piperazin-1-yl]-3-methyl-butan-1-one 1-[(3S)-3-(3,4-dimethoxyphenyl)-…
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) | 2.44 | 6.37 | -11.44 | 0 | 5 | 0 | 42 | 320.433 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.44 | 8.37 | -50.46 | 1 | 5 | 1 | 43 | 321.441 | 5 | ↓ |