In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2009 | 16 | Yes |
Popular Name: (2S)-3-[3-[(2R)-2-methyl-1-piperidyl]propylamino]propane-1,2-diol (2S)-3-[3-[(2R)-2-methyl-1-piper…
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) | 0.01 | 1.13 | -104.29 | 5 | 4 | 2 | 61 | 232.368 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.01 | -0.98 | -42.07 | 4 | 4 | 1 | 60 | 231.36 | 7 | ↓ |