In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 20 | Yes |
Popular Name: 1-[(3R)-3-(3-methoxyphenyl)-4-methyl-piperazin-1-yl]butan-1-one 1-[(3R)-3-(3-methoxyphenyl)-4-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) | 2.61 | 5.83 | -10.44 | 0 | 4 | 0 | 33 | 276.38 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.61 | 7.84 | -46.54 | 1 | 4 | 1 | 34 | 277.388 | 4 | ↓ |