In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 16 | Yes |
Popular Name: N-[[(3S)-1-(3,3-dimethylbutyl)-3-piperidyl]methyl]ethanamine N-[[(3S)-1-(3,3-dimethylbutyl)-3…
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) | 2.90 | 8.47 | -98.32 | 3 | 2 | 2 | 21 | 228.424 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.90 | 6.26 | -36.55 | 2 | 2 | 1 | 20 | 227.416 | 6 | ↓ |