In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 21 | Yes |
Popular Name: 3-[4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]piperazin-1-yl]propanoic 3-[4-[[(3S)-3-methyl-1-piperidyl…
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) | 0.28 | 5.46 | -53.58 | 1 | 7 | 0 | 85 | 319.427 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.28 | 3.23 | -48.78 | 0 | 7 | -1 | 84 | 318.419 | 5 | ↓ |