In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 14 | Yes |
Popular Name: N,3-dimethyl-N-[[(2S)-2-piperidyl]methyl]butan-1-amine N,3-dimethyl-N-[[(2S)-2-piperidy…
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) | 2.68 | 7.44 | -111.95 | 3 | 2 | 2 | 21 | 200.37 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.68 | 5.56 | -31.25 | 2 | 2 | 1 | 20 | 199.362 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.68 | 6.17 | -33.05 | 2 | 2 | 1 | 16 | 199.362 | 5 | ↓ |