In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 17 | Yes |
Popular Name: N,N-dimethyl-1-[1-[[(2S)-2-piperidyl]methyl]-4-piperidyl]methanamine N,N-dimethyl-1-[1-[[(2S)-2-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) | 1.83 | 8.6 | -187.4 | 4 | 3 | 3 | 25 | 242.431 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 7.34 | -92.28 | 3 | 3 | 2 | 21 | 241.423 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 6.72 | -80.22 | 3 | 3 | 2 | 24 | 241.423 | 4 | ↓ |