In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 16 | Yes |
Popular Name: (2S,4R,5S)-N-[(1S,2R)-1,2-dimethylbutyl]-1,2,5-trimethyl-piperidin-4-amine (2S,4R,5S)-N-[(1S,2R)-1,2-dimeth…
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) | 3.28 | 6.1 | -33.42 | 2 | 2 | 1 | 20 | 227.416 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.28 | 8.06 | -96.06 | 3 | 2 | 2 | 21 | 228.424 | 4 | ↓ |