In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 20 | Yes |
Popular Name: (1R,5S)-3-(4,5-dimethylthiazol-2-yl)-8-methyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-3-(4,5-dimethylthiazol-2…
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) | 2.54 | 6.15 | -32.91 | 2 | 3 | 1 | 33 | 294.488 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.54 | 7.39 | -32.33 | 2 | 3 | 1 | 29 | 294.488 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.54 | 8.52 | -99.73 | 3 | 3 | 2 | 34 | 295.496 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.54 | 6.6 | -82.73 | 3 | 3 | 2 | 31 | 295.496 | 4 | ↓ |