In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 18 | Yes |
Popular Name: 1-[4-[[(1S)-1-methyl-2-pyrrolidin-1-yl-ethyl]amino]-1-piperidyl]ethanone 1-[4-[[(1S)-1-methyl-2-pyrrolidi…
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) | 0.64 | 5.51 | -41.83 | 2 | 4 | 1 | 37 | 254.398 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.64 | 6.75 | -126.04 | 3 | 4 | 2 | 41 | 255.406 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.64 | 4.74 | -43.07 | 2 | 4 | 1 | 40 | 254.398 | 4 | ↓ |